Structure Information
Structure

Compound Identification

SMILES

ClCCN(CCCl)C1=CC=C(C=C(C#N)C(=O)C2=CC=CC=C2)C=C1

InChIKey

InChIKey=NSBWVKKZJAZEMS-UHFFFAOYSA-N

Formula

C20H18Cl2N2O

Mass

373.28

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Phenylpropanoids and polyketides

Class

Linear 1,3-diarylpropanoids

Subclass

Chalcones and dihydrochalcones

Intermediate Tree Nodes

Not available

Direct Parent

Retrochalcones

Alternative Parents

Molecular Framework

Aromatic homomonocyclic compounds

Substituents

Retrochalcone - Cinnamic acid or derivatives - Benzoyl - Nitrogen mustard - Tertiary aliphatic/aromatic amine - Aniline or substituted anilines - Dialkylarylamine - Aryl ketone - Monocyclic benzene moiety - Alpha-branched alpha,beta-unsaturated-ketone - Benzenoid - Acryloyl-group - Enone - Alpha,beta-unsaturated ketone - Tertiary amine - Ketone - Carbonitrile - Nitrile - Alkyl halide - Organic oxide - Organohalogen compound - Organochloride - Organonitrogen compound - Alkyl chloride - Cyanide - Organic oxygen compound - Organic nitrogen compound - Amine - Hydrocarbon derivative - Organooxygen compound - Aromatic homomonocyclic compound

Description

This compound belongs to the class of organic compounds known as retrochalcones. These are a form of normal chalcones that are structurally distinguished by the lack of oxygen functionalities at the C2'- and C6'-positions.

External Descriptors

Not available

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