1-(3-Chlorobenzoyl)-5-methoxy-2-methyl-1H-indole-3-acetic acid

Details

Stereochemistry	ACHIRAL
Molecular Formula	C19H16ClNO4
Molecular Weight	357.788
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 1-(3-Chlorobenzoyl)-5-methoxy-2-methyl-1H-indole-3-acetic acid

Structure Search

SMILES

COC1=CC=C2N(C(=O)C3=CC(Cl)=CC=C3)C(C)=C(CC(O)=O)C2=C1

InChI

InChIKey=PXXTUBBLCCJTKH-UHFFFAOYSA-N

InChI=1S/C19H16ClNO4/c1-11-15(10-18(22)23)16-9-14(25-2)6-7-17(16)21(11)19(24)12-4-3-5-13(20)8-12/h3-9H,10H2,1-2H3,(H,22,23)

HIDE SMILES / InChI

Molecular Formula	C19H16ClNO4
Molecular Weight	357.788
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 `Sat Dec 16 19:23:26 GMT 2023` Edited by `admin` on `Sat Dec 16 19:23:26 GMT 2023`
Record UNII	5MQ8NNS2A3
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

1-(3-Chlorobenzoyl)-5-methoxy-2-methyl-1H-indole-3-acetic acid

Systematic Name

English

1H-Indole-3-acetic acid, 1-(3-chlorobenzoyl)-5-methoxy-2-methyl-

Systematic Name

English

2-(1-(3-Chlorobenzoyl)-5-methoxy-2-methyl-1H-indol-3-yl)acetic acid

Systematic Name

English

Indomethacin impurity E [EP Impurity]

Common Name

English

[1-(3-Chlorobenzoyl)-5-methoxy-2-methyl-1H-indol-3-yl]acetic acid

Systematic Name

English

Code System Code Type Description

CAS

807614-94-4

Created by admin on Sat Dec 16 19:23:26 GMT 2023 , Edited by admin on Sat Dec 16 19:23:26 GMT 2023

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FDA UNII

5MQ8NNS2A3

Created by admin on Sat Dec 16 19:23:26 GMT 2023 , Edited by admin on Sat Dec 16 19:23:26 GMT 2023

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PUBCHEM

12049649

Created by admin on Sat Dec 16 19:23:26 GMT 2023 , Edited by admin on Sat Dec 16 19:23:26 GMT 2023

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EPA CompTox

DTXSID30476496

Created by admin on Sat Dec 16 19:23:26 GMT 2023 , Edited by admin on Sat Dec 16 19:23:26 GMT 2023

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