Structure Information
Structure

Compound Identification

SMILES

ClC1=CC2=C(OCC(=C2)C2=CC=C(Br)C=C2)C=C1

InChIKey

InChIKey=KWAKVJZFAVKZLT-UHFFFAOYSA-N

Formula

C15H10BrClO

Mass

321.6

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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-enes

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Isoflav-3-ene skeleton - Benzopyran - 1-benzopyran - Alkyl aryl ether - Bromobenzene - Halobenzene - Aryl bromide - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Benzenoid - Ether - Organoheterocyclic compound - Oxacycle - Hydrocarbon derivative - Organic oxygen compound - Organohalogen compound - Organobromide - Organochloride - Organooxygen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as isoflav-3-enes. These are flavonoids with a structure based on the 3-phenylchromene skeleton, with a double bond between the C3 and C4 carbon atoms of the chromene moiety.

External Descriptors

Not available

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