Structure Information
Structure

Compound Identification

SMILES

COC1=C2[C@H](Br)[C@@H](O)C[C@H]3CN(C(=O)C4=CC=CC=C4)C(C=C1)=C23

InChIKey

InChIKey=KHJKDQLNQJMPAO-XAYKYTGQSA-N

Formula

C19H18BrNO3

Mass

388.261

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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 - Tetralin - Benzamide - Benzoic acid or derivatives - Isoindole or derivatives - Anisole - Benzoyl - Phenol ether - Alkyl aryl ether - Monocyclic benzene moiety - Benzenoid - Tertiary carboxylic acid amide - Secondary alcohol - Bromohydrin - Carboxamide group - Halohydrin - Azacycle - Ether - Carboxylic acid derivative - Organonitrogen compound - Organic nitrogen compound - Organohalogen compound - Organobromide - Hydrocarbon derivative - Alcohol - Organic oxide - Organic oxygen compound - Alkyl halide - Alkyl bromide - Organooxygen 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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