Structure Information
Structure

Compound Identification

SMILES

OC1C(CC2=CC=CC=C2)COC2=C1C=C(OCC1=NC(Cl)=CC=C1)C=C2

InChIKey

InChIKey=ZVMPXPJYCKVQAA-UHFFFAOYSA-N

Formula

C22H20ClNO3

Mass

381.86

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Phenylpropanoids and polyketides

Class

Homoisoflavonoids

Subclass

Homoisoflavans

Intermediate Tree Nodes

Not available

Direct Parent

Homoisoflavans

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Homoisoflavan - Chromane - Benzopyran - 1-benzopyran - Phenol ether - Alkyl aryl ether - 2-halopyridine - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Benzenoid - Pyridine - Heteroaromatic compound - Secondary alcohol - Oxacycle - Azacycle - Organoheterocyclic compound - Ether - Organic oxygen compound - Organic nitrogen compound - Alcohol - Hydrocarbon derivative - Organooxygen compound - Organohalogen compound - Organochloride - Organonitrogen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as homoisoflavans. These are homoisoflavonoids with a structure based on the chromane system. Chromone is a bicyclic compound consisting of a 3,4-dihydro-1-benzopyran.

External Descriptors

Not available

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