Substances (GSRS)

2-CHLORO-5-NITRO-N-PHENYLBENZAMIDE

Also: BENZAMIDE, 2-CHLORO-5-NITRO-N-PHENYL-, GW9662

chemicalUNII UM18UZV2YD

Open FDA's page for this record

Substance class

chemical

Definition type

PRIMARY

Definition level

COMPLETE

Uuid

050638ba-5d93-4932-87a6-36573aa49548

Version

UNII

UM18UZV2YD

Codes

Uuid
d69df134-d920-4330-a440-3666ec8802fd
Code
22978-25-2
Type
PRIMARY
Url
https://commonchemistry.cas.org/detail?cas_rn=22978-25-2
Code system
CAS
References
02099e85-dafb-47a0-b20d-2a7268a075b0, 785923c9-9d86-495f-b3b1-5db5cfee26ef
Uuid
b96cf3b8-8da0-45d9-bc52-6fc3304effe7
Code
644213
Type
PRIMARY
Url
https://pubchem.ncbi.nlm.nih.gov/compound/644213
Code system
PUBCHEM
References
02099e85-dafb-47a0-b20d-2a7268a075b0
Uuid
12081b1c-e212-15cb-df77-47bcefe82a6b
Code
DTXSID8040723
Type
PRIMARY
Url
https://comptox.epa.gov/dashboard/chemical/details/DTXSID8040723
Code system
EPA CompTox
References
d9bddac8-052e-e228-ed5f-8356bdff5cef
Uuid
54080c9b-5988-4740-9d5b-559fdaf71f40
Code
UM18UZV2YD
Type
PRIMARY
Code system
FDA UNII
Uuid
e9d7aeaf-bd49-ee77-749f-f872e4ac617c
Code
DB07863
Type
PRIMARY
Url
http://www.drugbank.ca/drugs/DB07863
Code system
DRUG BANK
References
abb76d88-044e-253c-6719-bb2dc5d2a16e

Names

Uuid
83e0aa59-423f-4852-bdb4-2c34b1541b64
Name
2-CHLORO-5-NITRO-N-PHENYLBENZAMIDE
StdName
2-CHLORO-5-NITRO-N-PHENYLBENZAMIDE
Type
sys
Preferred
false
Display name
true
Languages
en
References
1645d726-6445-4956-9851-2e2f4a2b1f56
Uuid
c921bb3b-0045-a5a1-559d-a9877cccc506
Name
BENZAMIDE, 2-CHLORO-5-NITRO-N-PHENYL-
StdName
BENZAMIDE, 2-CHLORO-5-NITRO-N-PHENYL-
Type
sys
Preferred
false
Display name
false
Languages
en
References
785923c9-9d86-495f-b3b1-5db5cfee26ef
Uuid
68b8ab2b-b9d3-c0e7-9437-86f61fac4632
Name
GW9662
StdName
GW9662
Type
cd
Preferred
false
Display name
false
Languages
en
References
785923c9-9d86-495f-b3b1-5db5cfee26ef

References

Uuid
1645d726-6445-4956-9851-2e2f4a2b1f56
Citation
CFSAN
Doc type
SRS
Public domain
true
Tags
NOMEN
Uuid
02099e85-dafb-47a0-b20d-2a7268a075b0
Citation
SRS CODE IMPORT
Doc type
SRS
Public domain
true
Document date
1493392498000
Tags
NOMEN
Uuid
d9bddac8-052e-e228-ed5f-8356bdff5cef
Citation
WEBSITE
Url
https://comptox.epa.gov/dashboard/dsstoxdb/results?utf8=%E2%9C%93&search=22978-25-2
Doc type
WEBSITE
Public domain
true
Tags
NOMEN, PUBLIC_DOMAIN_RELEASE
Uuid
abb76d88-044e-253c-6719-bb2dc5d2a16e
Doc type
SYSTEM
Public domain
true
Uuid
785923c9-9d86-495f-b3b1-5db5cfee26ef
Citation
STN
Doc type
STN (SCIFINDER)
Public domain
true

Moieties

Uuid
bb1d76a4-f01d-46c0-9f59-7512489cd38d
ID
bb1d76a4-f01d-46c0-9f59-7512489cd38d
Smiles
c1ccc(cc1)NC(=O)c2cc(ccc2Cl)[N+](=O)[O-]
Formula
C13H9ClN2O3
Atropisomerism
No
Charge
0
Count
1
Stereochemistry
ACHIRAL
Defined stereo
0
Ez centers
0
Molecular weight
276.6756
Optical activity
NONE
Stereo centers
0
Molfile
Marvin 01132109412D 19 20 0 0 0 0 999 V2000 0.7147 -0.4121 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 0.7147 -1.2362 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 0.0000 -1.6547 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4294 -1.6547 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4294 -2.4788 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1440 -2.8910 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8588 -2.4788 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5799 -2.8910 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 2.8588 -1.6547 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1440 -1.2362 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5799 -1.2362 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5799 -0.4121 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2946 -1.6547 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.0092 -1.2362 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7239 -1.6547 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4386 -1.2362 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4386 -0.4121 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7239 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0092 -0.4121 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2 1 1 0 0 0 0 2 3 2 0 0 0 0 4 2 1 0 0 0 0 4 5 1 0 0 0 0 10 4 2 0 0 0 0 6 5 2 0 0 0 0 7 6 1 0 0 0 0 7 8 1 0 0 0 0 9 7 2 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 15 14 1 0 0 0 0 19 14 2 0 0 0 0 16 15 2 0 0 0 0 17 16 1 0 0 0 0 17 18 2 0 0 0 0 18 19 1 0 0 0 0 M CHG 2 1 -1 2 1 M END
Count amount
Type
MOL RATIO
Average
1
Units
MOL RATIO
Uuid
c76674da-b114-4cee-a12e-68dfed1461c3

Structure

ID: c6e64538-0bc0-4cd1-ba02-4e251e2763ca
Smiles: c1ccc(cc1)NC(=O)c2cc(ccc2Cl)[N+](=O)[O-]
Formula: C13H9ClN2O3
Atropisomerism: No
Charge: 0
Count: 1
Stereochemistry: ACHIRAL
Defined stereo: 0
Ez centers: 0
Molecular weight: 276.6756
Optical activity: NONE
Stereo centers: 0
Molfile: Marvin 01132110172D 19 20 0 0 0 0 999 V2000 14.9615 -4.2950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9615 -5.1192 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2467 -3.8766 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2467 -5.5314 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5321 -4.2950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5321 -5.1192 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8174 -3.8766 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 12.8174 -3.0525 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.1027 -4.2950 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 15.6826 -5.5314 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 15.6826 -3.8766 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.3973 -4.2950 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 15.6826 -3.0525 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.5413 -3.0525 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.5413 -3.8766 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.8266 -2.6404 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.8266 -4.2950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.1119 -3.0525 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.1119 -3.8766 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 3 2 0 0 0 0 1 11 1 0 0 0 0 2 4 2 0 0 0 0 2 10 1 0 0 0 0 3 5 1 0 0 0 0 4 6 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 11 12 1 0 0 0 0 11 13 2 0 0 0 0 12 19 1 0 0 0 0 14 15 1 0 0 0 0 14 16 2 0 0 0 0 15 17 2 0 0 0 0 16 18 1 0 0 0 0 17 19 1 0 0 0 0 18 19 2 0 0 0 0 M CHG 2 7 1 9 -1 M END
References: 1645d726-6445-4956-9851-2e2f4a2b1f56

Data from openFDA, FDA's public API. FDA says not to rely on it to make decisions about medical care and to treat every result as unvalidated; confirm against FDA's own record and the product labeling. Not medical or legal advice.