Structure Information
Structure

Compound Identification

SMILES

OC(=O)C1=C(CCS)C2=CC=CC=C2N1CC1=C(Br)C=CC(=C1)C(O)=O

InChIKey

InChIKey=XARQBKGNAFMNRA-UHFFFAOYSA-N

Formula

C19H16BrNO4S

Mass

434.3

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Indoles and derivatives

Subclass

Indolecarboxylic acids and derivatives

Intermediate Tree Nodes

Not available

Direct Parent

Indolecarboxylic acids and derivatives

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Indolecarboxylic acid derivative - 4-halobenzoic acid or derivatives - N-alkylindole - Halobenzoic acid or derivatives - 4-halobenzoic acid - 3-alkylindole - Halobenzoic acid - Indole - Benzoic acid or derivatives - Benzoic acid - Benzoyl - Pyrrole-2-carboxylic acid - Pyrrole-2-carboxylic acid or derivatives - Halobenzene - Bromobenzene - Substituted pyrrole - Aryl halide - Aryl bromide - Monocyclic benzene moiety - Benzenoid - Pyrrole - Heteroaromatic compound - Alkylthiol - Azacycle - Carboxylic acid derivative - Carboxylic acid - Organic nitrogen compound - Organooxygen compound - Organosulfur compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organonitrogen compound - Organobromide - Organohalogen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as indolecarboxylic acids and derivatives. These are compounds containing a carboxylic acid group (or a derivative thereof) linked to an indole.

External Descriptors

Not available

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