2-Chloro-5-[(methylamino)sulfonyl]benzoic acid

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C8H8ClNO4S
Molecular Weight	249.671
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 2-Chloro-5-[(methylamino)sulfonyl]benzoic acid

Structure Search

SMILES

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

InChI

InChIKey=RULGDFLFEUYACU-UHFFFAOYSA-N

InChI=1S/C8H8ClNO4S/c1-10-15(13,14)5-2-3-7(9)6(4-5)8(11)12/h2-4,10H,1H3,(H,11,12)

HIDE SMILES / InChI

Molecular Formula	C8H8ClNO4S
Molecular Weight	249.671
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 17:42:22 GMT 2025` Edited by `admin` on `Tue Apr 01 17:42:22 GMT 2025`
Record UNII	D8DQY2GNF6
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

2-Chloro-5-[(methylamino)sulfonyl]benzoic acid

Systematic Name

English

Benzoic acid, 2-chloro-5-[(methylamino)sulfonyl]-

Preferred Name

English

Benzoic acid, 2-chloro-5-(methylsulfamoyl)-

Systematic Name

English

Code System Code Type Description

FDA UNII

D8DQY2GNF6

Created by admin on Tue Apr 01 17:42:22 GMT 2025 , Edited by admin on Tue Apr 01 17:42:22 GMT 2025

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ECHA (EC/EINECS)

272-652-6

Created by admin on Tue Apr 01 17:42:22 GMT 2025 , Edited by admin on Tue Apr 01 17:42:22 GMT 2025

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CAS

68901-09-7

Created by admin on Tue Apr 01 17:42:22 GMT 2025 , Edited by admin on Tue Apr 01 17:42:22 GMT 2025

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EPA CompTox

DTXSID6071821

Created by admin on Tue Apr 01 17:42:22 GMT 2025 , Edited by admin on Tue Apr 01 17:42:22 GMT 2025

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PUBCHEM

111724

Created by admin on Tue Apr 01 17:42:22 GMT 2025 , Edited by admin on Tue Apr 01 17:42:22 GMT 2025

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