Structure Information
Structure

Compound Identification

SMILES

CN(C)C1=CC=C(C=C2CCCC3C(N(N=C23)C(=O)C2=CC(Cl)=CC=C2)C2=CC=C(C=C2)N(C)C)C=C1

InChIKey

InChIKey=SZZREXPBJCUKKT-UHFFFAOYSA-N

Formula

C31H33ClN4O

Mass

513.08

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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

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Linear 1,7-diphenylheptane skeleton - 3-halobenzoic acid or derivatives - Halobenzoic acid or derivatives - Benzoic acid or derivatives - Benzoyl - Aniline or substituted anilines - Dialkylarylamine - Tertiary aliphatic/aromatic amine - Chlorobenzene - Halobenzene - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Benzenoid - Pyrazoline - N-alkylated hydrazone - Tertiary amine - Amino acid or derivatives - Organoheterocyclic compound - Carboxylic acid derivative - Azacycle - Organic oxide - Amine - Organic oxygen compound - Organic nitrogen compound - Organochloride - Organooxygen compound - Hydrocarbon derivative - Organonitrogen compound - Organohalogen 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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