Structure Information
Structure

Compound Identification

SMILES

CC1=C(C=CC(NC(=O)C2=CC(Cl)=CC=C2)=C1)C1=CC2=CC=CC=C2OC1=O

InChIKey

InChIKey=HOODMRLIYWPLKN-UHFFFAOYSA-N

Formula

C23H16ClNO3

Mass

389.84

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Phenylpropanoids and polyketides

Class

Isoflavonoids

Subclass

Isoflav-3-enes

Intermediate Tree Nodes

Not available

Direct Parent

Isoflav-3-enones

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Isoflav-3-enone skeleton - Benzanilide - Aromatic anilide - Coumarin - 3-halobenzoic acid or derivatives - Halobenzoic acid or derivatives - 1-benzopyran - Benzopyran - Benzamide - Benzoic acid or derivatives - Benzoyl - Toluene - Pyranone - Chlorobenzene - Halobenzene - Benzenoid - Monocyclic benzene moiety - Aryl chloride - Pyran - Aryl halide - Heteroaromatic compound - Lactone - Secondary carboxylic acid amide - Carboxamide group - Oxacycle - Organoheterocyclic compound - Carboxylic acid derivative - Organic oxygen compound - Organooxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organonitrogen compound - Organochloride - Organohalogen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as isoflav-3-enones. These are flavonoids with a structure based on an isoflav-3-ene skeleton bearing an oxo-group at position C2.

External Descriptors

Not available

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