3-[[3-(3-Aminophenyl)-1,3-dioxopropyl]amino]-4-methoxybenzenesulfonic acid

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Details

Stereochemistry	ACHIRAL
Molecular Formula	C16H16N2O6S
Molecular Weight	364.373
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 3-[[3-(3-Aminophenyl)-1,3-dioxopropyl]amino]-4-methoxybenzenesulfonic acid

Structure Search

SMILES

COC1=C(NC(=O)CC(=O)C2=CC(N)=CC=C2)C=C(C=C1)S(O)(=O)=O

InChI

InChIKey=HUWZJDFGTKZUCX-UHFFFAOYSA-N

InChI=1S/C16H16N2O6S/c1-24-15-6-5-12(25(21,22)23)8-13(15)18-16(20)9-14(19)10-3-2-4-11(17)7-10/h2-8H,9,17H2,1H3,(H,18,20)(H,21,22,23)

HIDE SMILES / InChI

Molecular Formula	C16H16N2O6S
Molecular Weight	364.373
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 19:07:10 GMT 2025` Edited by `admin` on `Tue Apr 01 19:07:10 GMT 2025`
Record UNII	Y2CWD7MZT6
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

Benzenesulfonic acid, 3-[[3-(3-aminophenyl)-1,3-dioxopropyl]amino]-4-methoxy-

Preferred Name

English

3-[[3-(3-Aminophenyl)-1,3-dioxopropyl]amino]-4-methoxybenzenesulfonic acid

Systematic Name

English

Code System Code Type Description

CAS

94133-74-1

Created by admin on Tue Apr 01 19:07:10 GMT 2025 , Edited by admin on Tue Apr 01 19:07:10 GMT 2025

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PUBCHEM

3023649

Created by admin on Tue Apr 01 19:07:10 GMT 2025 , Edited by admin on Tue Apr 01 19:07:10 GMT 2025

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FDA UNII

Y2CWD7MZT6

Created by admin on Tue Apr 01 19:07:10 GMT 2025 , Edited by admin on Tue Apr 01 19:07:10 GMT 2025

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EPA CompTox

DTXSID30240679

Created by admin on Tue Apr 01 19:07:10 GMT 2025 , Edited by admin on Tue Apr 01 19:07:10 GMT 2025

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ECHA (EC/EINECS)

302-737-6

Created by admin on Tue Apr 01 19:07:10 GMT 2025 , Edited by admin on Tue Apr 01 19:07:10 GMT 2025

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