Structure Information
Structure

Compound Identification

SMILES

BrC1=CC=C(C=C1)C1NC(C2CCCC1C2=O)C1=CC=C(Br)C=C1

InChIKey

InChIKey=QVDGXRZENJEJRK-UHFFFAOYSA-N

Formula

C20H19Br2NO

Mass

449.186

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Phenylpropanoids and polyketides

Class

Diarylheptanoids

Subclass

Linear diarylheptanoids

Intermediate Tree Nodes

Not available

Direct Parent

Linear diarylheptanoids

Alternative Parents

Phenylpiperidines Piperidinones Bromobenzenes Aralkylamines Aryl bromides Ketones Dialkylamines Azacyclic compounds Organobromides Organic oxides Hydrocarbon derivatives

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Linear 1,7-diphenylheptane skeleton - Phenylpiperidine - Bromobenzene - Aralkylamine - Piperidinone - Halobenzene - Aryl bromide - Aryl halide - Monocyclic benzene moiety - Benzenoid - Piperidine - Ketone - Azacycle - Organoheterocyclic compound - Secondary amine - Secondary aliphatic amine - Amine - Organohalogen compound - Organobromide - Organonitrogen compound - Organooxygen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as linear diarylheptanoids. These are diarylheptanoids with an open heptane chain. The two aromatic rings are linked only by the heptane chain.

External Descriptors

Not available

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