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

Details

Stereochemistry ACHIRAL
Molecular Formula C7H8N2O6S
Molecular Weight 248.213
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 5-Methoxy-2-nitrosulphanilic acid

SMILES

COC1=CC(=C(C=C1N)[N+]([O-])=O)S(O)(=O)=O

InChI

InChIKey=TVPOUNICERMHNR-UHFFFAOYSA-N
InChI=1S/C7H8N2O6S/c1-15-6-3-7(16(12,13)14)5(9(10)11)2-4(6)8/h2-3H,8H2,1H3,(H,12,13,14)

HIDE SMILES / InChI

Molecular Formula C7H8N2O6S
Molecular Weight 248.213
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 13:09:17 GMT 2023
Edited
by admin
on Sat Dec 16 13:09:17 GMT 2023
Record UNII
VP4FHW6FBC
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
5-Methoxy-2-nitrosulphanilic acid
Systematic Name English
Benzenesulfonic acid, 4-amino-5-methoxy-2-nitro-
Systematic Name English
4-Amino-5-methoxy-2-nitrobenzenesulfonic acid
Systematic Name English
Code System Code Type Description
ECHA (EC/EINECS)
275-899-8
Created by admin on Sat Dec 16 13:09:17 GMT 2023 , Edited by admin on Sat Dec 16 13:09:17 GMT 2023
PRIMARY
PUBCHEM
16205255
Created by admin on Sat Dec 16 13:09:17 GMT 2023 , Edited by admin on Sat Dec 16 13:09:17 GMT 2023
PRIMARY
CAS
71720-50-8
Created by admin on Sat Dec 16 13:09:17 GMT 2023 , Edited by admin on Sat Dec 16 13:09:17 GMT 2023
PRIMARY
FDA UNII
VP4FHW6FBC
Created by admin on Sat Dec 16 13:09:17 GMT 2023 , Edited by admin on Sat Dec 16 13:09:17 GMT 2023
PRIMARY
EPA CompTox
DTXSID10221941
Created by admin on Sat Dec 16 13:09:17 GMT 2023 , Edited by admin on Sat Dec 16 13:09:17 GMT 2023
PRIMARY