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Details

Stereochemistry ACHIRAL
Molecular Formula C10H11ClN2O6S
Molecular Weight 322.722
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 5-(Aminosulfonyl)-4-chloro-2-[(ethoxycarbonyl)amino]benzoic acid

SMILES

CCOC(=O)NC1=CC(Cl)=C(C=C1C(O)=O)S(N)(=O)=O

InChI

InChIKey=QSKGWLGYGDCAKH-UHFFFAOYSA-N
InChI=1S/C10H11ClN2O6S/c1-2-19-10(16)13-7-4-6(11)8(20(12,17)18)3-5(7)9(14)15/h3-4H,2H2,1H3,(H,13,16)(H,14,15)(H2,12,17,18)

HIDE SMILES / InChI

Molecular Formula C10H11ClN2O6S
Molecular Weight 322.722
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 Wed Apr 02 15:11:46 GMT 2025
Edited
by admin
on Wed Apr 02 15:11:46 GMT 2025
Record UNII
EF2U86GE96
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
5-(Aminosulfonyl)-4-chloro-2-[(ethoxycarbonyl)amino]benzoic acid
Systematic Name English
Benzoic acid, 5-(aminosulfonyl)-4-chloro-2-[(ethoxycarbonyl)amino]-
Preferred Name English
Code System Code Type Description
FDA UNII
EF2U86GE96
Created by admin on Wed Apr 02 15:11:46 GMT 2025 , Edited by admin on Wed Apr 02 15:11:46 GMT 2025
PRIMARY
CAS
35442-36-5
Created by admin on Wed Apr 02 15:11:46 GMT 2025 , Edited by admin on Wed Apr 02 15:11:46 GMT 2025
PRIMARY
PUBCHEM
134990746
Created by admin on Wed Apr 02 15:11:46 GMT 2025 , Edited by admin on Wed Apr 02 15:11:46 GMT 2025
PRIMARY
EPA CompTox
DTXSID301170633
Created by admin on Wed Apr 02 15:11:46 GMT 2025 , Edited by admin on Wed Apr 02 15:11:46 GMT 2025
PRIMARY