Structure Information
Structure

Compound Identification

SMILES

BrC1=CC2=C(OC(N3CCOCC3)C(=C2)C(=O)C2=CC=CC=C2)C=C1

InChIKey

InChIKey=SUPYCNZLBMTYKU-UHFFFAOYSA-N

Formula

C20H18BrNO3

Mass

400.272

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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 - Benzopyran - 1-benzopyran - Benzoyl - Aryl ketone - Aryl bromide - Aryl halide - Monocyclic benzene moiety - Morpholine - Oxazinane - Benzenoid - Ketone - Oxacycle - Ether - Dialkyl ether - Organoheterocyclic compound - Azacycle - Organooxygen compound - Organonitrogen compound - Organobromide - Organohalogen compound - Organic oxygen compound - Amine - Hydrocarbon derivative - Organic oxide - Organic nitrogen 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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