Structure Information
Structure

Compound Identification

SMILES

ClC1=CC(Br)=C2C(C3CCN(CC3)C(=O)CC3CCCCC3=O)C3=NC=C(Br)C=C3CCC2=C1

InChIKey

InChIKey=JMSZKERFZVAMIQ-UHFFFAOYSA-N

Formula

C27H29Br2ClN2O2

Mass

608.8

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Benzocycloheptapyridines

Subclass

Not available

Intermediate Tree Nodes

Not available

Direct Parent

Benzocycloheptapyridines

Alternative Parents

N-acylpiperidines Pyridines and derivatives Benzenoids Aryl chlorides Aryl bromides Tertiary carboxylic acid amides Heteroaromatic compounds Cyclic ketones Azacyclic compounds Organonitrogen compounds Organochlorides Organobromides Organic oxides Hydrocarbon derivatives

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Benzocycloheptapyridine - N-acyl-piperidine - Aryl bromide - Aryl chloride - Aryl halide - Benzenoid - Piperidine - Pyridine - Heteroaromatic compound - Tertiary carboxylic acid amide - Carboxamide group - Ketone - Cyclic ketone - Azacycle - Carboxylic acid derivative - Organochloride - Organobromide - Organohalogen compound - Organic nitrogen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organonitrogen compound - Organooxygen compound - Organic oxygen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as benzocycloheptapyridines. These are aromatic compounds containing a benzene ring and a pyridine ring fused to a seven membered carbocycle.

External Descriptors

Not available

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