U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ACHIRAL
Molecular Formula C6H6N2O5S
Molecular Weight 218.187
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 4-AMINO-2-NITROBENZENESULFONIC ACID

SMILES

NC1=CC=C(C(=C1)[N+]([O-])=O)S(O)(=O)=O

InChI

InChIKey=ZNMGCJDUZADKPW-UHFFFAOYSA-N
InChI=1S/C6H6N2O5S/c7-4-1-2-6(14(11,12)13)5(3-4)8(9)10/h1-3H,7H2,(H,11,12,13)

HIDE SMILES / InChI

Molecular Formula C6H6N2O5S
Molecular Weight 218.187
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 Tue Apr 01 20:22:51 GMT 2025
Edited
by admin
on Tue Apr 01 20:22:51 GMT 2025
Record UNII
86V4WYA72Q
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
4-AMINO-2-NITROBENZENESULFONIC ACID
Systematic Name English
NSC-37402
Preferred Name English
BENZENESULFONIC ACID, 4-AMINO-2-NITRO-
Common Name English
4-AMINO-2-NITROBENZENESULPHONIC ACID
Systematic Name English
1-AMINO-3-NITROBENZENE-4-SULFONIC ACID
Common Name English
2-NITROSULFANILIC ACID
Systematic Name English
1-AMINO-3-NITROBENZENE-4-SULPHONIC ACID
Common Name English
BENZENESULPHONIC ACID, 4-AMINO-2-NITRO-
Systematic Name English
2-NITROSULPHANILIC ACID
Systematic Name English
Code System Code Type Description
ECHA (EC/EINECS)
211-920-9
Created by admin on Tue Apr 01 20:22:51 GMT 2025 , Edited by admin on Tue Apr 01 20:22:51 GMT 2025
PRIMARY
NSC
37402
Created by admin on Tue Apr 01 20:22:51 GMT 2025 , Edited by admin on Tue Apr 01 20:22:51 GMT 2025
PRIMARY
EPA CompTox
DTXSID4061046
Created by admin on Tue Apr 01 20:22:51 GMT 2025 , Edited by admin on Tue Apr 01 20:22:51 GMT 2025
PRIMARY
FDA UNII
86V4WYA72Q
Created by admin on Tue Apr 01 20:22:51 GMT 2025 , Edited by admin on Tue Apr 01 20:22:51 GMT 2025
PRIMARY
CAS
712-24-3
Created by admin on Tue Apr 01 20:22:51 GMT 2025 , Edited by admin on Tue Apr 01 20:22:51 GMT 2025
PRIMARY
PUBCHEM
69735
Created by admin on Tue Apr 01 20:22:51 GMT 2025 , Edited by admin on Tue Apr 01 20:22:51 GMT 2025
PRIMARY