3-(((3-CARBOXYPHENYL)SULFONYL)THIO)BENZOIC ACID

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C14H10O6S2
Molecular Weight	338.356
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 3-(((3-CARBOXYPHENYL)SULFONYL)THIO)BENZOIC ACID

Structure Search

SMILES

OC(=O)C1=CC(SS(=O)(=O)C2=CC=CC(=C2)C(O)=O)=CC=C1

InChI

InChIKey=ZLXBDOQCIJHJQV-UHFFFAOYSA-N

InChI=1S/C14H10O6S2/c15-13(16)9-3-1-5-11(7-9)21-22(19,20)12-6-2-4-10(8-12)14(17)18/h1-8H,(H,15,16)(H,17,18)

HIDE SMILES / InChI

Molecular Formula	C14H10O6S2
Molecular Weight	338.356
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 19:31:05 GMT 2025` Edited by `admin` on `Tue Apr 01 19:31:05 GMT 2025`
Record UNII	SZ5E435VM3
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

NSC-342015

Preferred Name

English

3-(((3-CARBOXYPHENYL)SULFONYL)THIO)BENZOIC ACID

Systematic Name

English

Benzoic acid, m-thiosulfo-, S-m-carboxyphenyl ester

Common Name

English

Benzoic acid, 3-[[(3-carboxyphenyl)sulfonyl]thio]-

Systematic Name

English

Code System Code Type Description

CAS

1234-18-0

Created by admin on Tue Apr 01 19:31:05 GMT 2025 , Edited by admin on Tue Apr 01 19:31:05 GMT 2025

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PUBCHEM

334892

Created by admin on Tue Apr 01 19:31:05 GMT 2025 , Edited by admin on Tue Apr 01 19:31:05 GMT 2025

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FDA UNII

SZ5E435VM3

Created by admin on Tue Apr 01 19:31:05 GMT 2025 , Edited by admin on Tue Apr 01 19:31:05 GMT 2025

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EPA CompTox

DTXSID10154003

Created by admin on Tue Apr 01 19:31:05 GMT 2025 , Edited by admin on Tue Apr 01 19:31:05 GMT 2025

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NSC

342015

Created by admin on Tue Apr 01 19:31:05 GMT 2025 , Edited by admin on Tue Apr 01 19:31:05 GMT 2025

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