DICARBOXYLIC TOLMETIN

Details

Stereochemistry	ACHIRAL
Molecular Formula	C15H13NO5
Molecular Weight	287.2674
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CN1C(CC(O)=O)=CC=C1C(=O)C2=CC=C(C=C2)C(O)=O

InChI

InChIKey=JARNTMCBHAXPKM-UHFFFAOYSA-N

InChI=1S/C15H13NO5/c1-16-11(8-13(17)18)6-7-12(16)14(19)9-2-4-10(5-3-9)15(20)21/h2-7H,8H2,1H3,(H,17,18)(H,20,21)

HIDE SMILES / InChI

Molecular Formula	C15H13NO5
Molecular Weight	287.2674
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 21:53:05 GMT 2025` Edited by `admin` on `Tue Apr 01 21:53:05 GMT 2025`
Record UNII	GW77GP7KOA
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

DICARBOXYLIC TOLMETIN

Common Name

English

MCN 2987

Preferred Name

English

5-(P-CARBOXYBENZOYL)-1-METHYLPYRROLE-2-ACETIC ACID

Systematic Name

English

4-(5-(CARBOXYMETHYL)-1-METHYL-PYRROLE-2-CARBONYL)BENZOIC ACID

Systematic Name

English

1-METHYL-5-(P-CARBOXYBENZOYL)PYRROLE-2-ACETIC ACID

Systematic Name

English

1H-PYRROLE-2-ACETIC ACID, 5-(4-CARBOXYBENZOYL)-1-METHYL-

Systematic Name

English

Code System Code Type Description

PUBCHEM

193897

Created by admin on Tue Apr 01 21:53:05 GMT 2025 , Edited by admin on Tue Apr 01 21:53:05 GMT 2025

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FDA UNII

GW77GP7KOA

Created by admin on Tue Apr 01 21:53:05 GMT 2025 , Edited by admin on Tue Apr 01 21:53:05 GMT 2025

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CAS

53421-39-9

Created by admin on Tue Apr 01 21:53:05 GMT 2025 , Edited by admin on Tue Apr 01 21:53:05 GMT 2025

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EPA CompTox

DTXSID90201589

Created by admin on Tue Apr 01 21:53:05 GMT 2025 , Edited by admin on Tue Apr 01 21:53:05 GMT 2025

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TOLMETIN

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