Structure Information
Structure

Compound Identification

SMILES

COC1=C2C(NC=C2C(=O)C(=O)N2CCN(CC2)C(=O)C2=CC=CC=C2)=C(Br)C=C1

InChIKey

InChIKey=NLJKWZBNIWOQAT-UHFFFAOYSA-N

Formula

C22H20BrN3O4

Mass

470.323

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Indoles and derivatives

Subclass

Indoles

Intermediate Tree Nodes

Not available

Direct Parent

Indoles

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Benzamide - Benzoic acid or derivatives - Indole - Anisole - Benzoyl - Aryl ketone - Alkyl aryl ether - 1,4-diazinane - Monocyclic benzene moiety - Benzenoid - Aryl halide - Substituted pyrrole - Aryl bromide - Piperazine - Vinylogous amide - Heteroaromatic compound - Tertiary carboxylic acid amide - Pyrrole - Ketone - Carboxamide group - Carboxylic acid derivative - Azacycle - Ether - Organic oxide - Organopnictogen compound - Carbonyl group - Organohalogen compound - Organic oxygen compound - Organobromide - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as indoles. These are compounds containing an indole moiety, which consists of pyrrole ring fused to benzene to form 2,3-benzopyrrole.

External Descriptors

Not available

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