2-Methoxy-4-amino-5-ethylsulfonyl benzoic acid

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C10H13NO5S
Molecular Weight	259.279
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 2-Methoxy-4-amino-5-ethylsulfonyl benzoic acid

Structure Search

SMILES

CCS(=O)(=O)C1=C(N)C=C(OC)C(=C1)C(O)=O

InChI

InChIKey=OJVNCXHGGYYOPH-UHFFFAOYSA-N

InChI=1S/C10H13NO5S/c1-3-17(14,15)9-4-6(10(12)13)8(16-2)5-7(9)11/h4-5H,3,11H2,1-2H3,(H,12,13)

HIDE SMILES / InChI

Molecular Formula	C10H13NO5S
Molecular Weight	259.279
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 `Mon Mar 31 20:58:23 GMT 2025` Edited by `admin` on `Mon Mar 31 20:58:23 GMT 2025`
Record UNII	QE5K498QLP
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

4-Amino-5-(ethylsulphonyl)-o-anisic acid

Preferred Name

English

2-Methoxy-4-amino-5-ethylsulfonyl benzoic acid

Systematic Name

English

4-Amino-5-(ethylsulfonyl)-2-methoxybenzoic acid

Systematic Name

English

Benzoic acid, 4-amino-5-(ethylsulfonyl)-2-methoxy-

Systematic Name

English

Code System Code Type Description

CAS

71675-87-1

Created by admin on Mon Mar 31 20:58:23 GMT 2025 , Edited by admin on Mon Mar 31 20:58:23 GMT 2025

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ECHA (EC/EINECS)

275-833-8

Created by admin on Mon Mar 31 20:58:23 GMT 2025 , Edited by admin on Mon Mar 31 20:58:23 GMT 2025

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FDA UNII

QE5K498QLP

Created by admin on Mon Mar 31 20:58:23 GMT 2025 , Edited by admin on Mon Mar 31 20:58:23 GMT 2025

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EPA CompTox

DTXSID80992277

Created by admin on Mon Mar 31 20:58:23 GMT 2025 , Edited by admin on Mon Mar 31 20:58:23 GMT 2025

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PUBCHEM

3018232

Created by admin on Mon Mar 31 20:58:23 GMT 2025 , Edited by admin on Mon Mar 31 20:58:23 GMT 2025

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