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

Details

Stereochemistry ACHIRAL
Molecular Formula C7H6ClNO4S
Molecular Weight 235.645
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 4-CHLORO-3-(AMINOSULFONYL)BENZOIC ACID

SMILES

NS(=O)(=O)C1=C(Cl)C=CC(=C1)C(O)=O

InChI

InChIKey=FHQAWINGVCDTTG-UHFFFAOYSA-N
InChI=1S/C7H6ClNO4S/c8-5-2-1-4(7(10)11)3-6(5)14(9,12)13/h1-3H,(H,10,11)(H2,9,12,13)

HIDE SMILES / InChI

Molecular Formula C7H6ClNO4S
Molecular Weight 235.645
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 10:37:42 GMT 2023
Edited
by admin
on Sat Dec 16 10:37:42 GMT 2023
Record UNII
Q45HDN52UH
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
4-CHLORO-3-(AMINOSULFONYL)BENZOIC ACID
Systematic Name English
4-CHLORO-5-SULFAMOYLBENZOIC ACID
Common Name English
BENZOIC ACID, 3-(AMINOSULFONYL)-4-CHLORO-
Systematic Name English
3-SULFAMYL-4-CHLOROBENZOIC ACID
Common Name English
Code System Code Type Description
PUBCHEM
14568
Created by admin on Sat Dec 16 10:37:42 GMT 2023 , Edited by admin on Sat Dec 16 10:37:42 GMT 2023
PRIMARY
FDA UNII
Q45HDN52UH
Created by admin on Sat Dec 16 10:37:42 GMT 2023 , Edited by admin on Sat Dec 16 10:37:42 GMT 2023
PRIMARY
CAS
1205-30-7
Created by admin on Sat Dec 16 10:37:42 GMT 2023 , Edited by admin on Sat Dec 16 10:37:42 GMT 2023
PRIMARY
EPA CompTox
DTXSID50152881
Created by admin on Sat Dec 16 10:37:42 GMT 2023 , Edited by admin on Sat Dec 16 10:37:42 GMT 2023
PRIMARY