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Details

Stereochemistry ACHIRAL
Molecular Formula C8H8N2O4
Molecular Weight 196.1601
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 4-(Methylamino)-3-nitrobenzoic acid

SMILES

CNC1=C(C=C(C=C1)C(O)=O)[N+]([O-])=O

InChI

InChIKey=KSMLIIWEQBYUKA-UHFFFAOYSA-N
InChI=1S/C8H8N2O4/c1-9-6-3-2-5(8(11)12)4-7(6)10(13)14/h2-4,9H,1H3,(H,11,12)

HIDE SMILES / InChI

Molecular Formula C8H8N2O4
Molecular Weight 196.1601
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 11:15:00 GMT 2023
Edited
by admin
on Sat Dec 16 11:15:00 GMT 2023
Record UNII
W3XW4KR39J
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
4-(Methylamino)-3-nitrobenzoic acid
Systematic Name English
Benzoic acid, 4-(methylamino)-3-nitro-
Systematic Name English
NSC-138300
Code English
Code System Code Type Description
CAS
41263-74-5
Created by admin on Sat Dec 16 11:15:01 GMT 2023 , Edited by admin on Sat Dec 16 11:15:01 GMT 2023
PRIMARY
EPA CompTox
DTXSID20300675
Created by admin on Sat Dec 16 11:15:01 GMT 2023 , Edited by admin on Sat Dec 16 11:15:01 GMT 2023
PRIMARY
NSC
138300
Created by admin on Sat Dec 16 11:15:01 GMT 2023 , Edited by admin on Sat Dec 16 11:15:01 GMT 2023
PRIMARY
PUBCHEM
7063595
Created by admin on Sat Dec 16 11:15:01 GMT 2023 , Edited by admin on Sat Dec 16 11:15:01 GMT 2023
PRIMARY
FDA UNII
W3XW4KR39J
Created by admin on Sat Dec 16 11:15:01 GMT 2023 , Edited by admin on Sat Dec 16 11:15:01 GMT 2023
PRIMARY
Related Record Type Details
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