Structure Information
Structure

Compound Identification

SMILES

COC1=CC(OC)=C(C=C1)C1C(C#N)C(=N)OC2=C1C=CC(=C2)N(C)C

InChIKey

InChIKey=IRDGLSYSNHRAHK-UHFFFAOYSA-N

Formula

C20H21N3O3

Mass

351.406

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Phenylpropanoids and polyketides

Class

Neoflavonoids

Subclass

Neoflavans

Intermediate Tree Nodes

Not available

Direct Parent

Neoflavans

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Neoflavan - Chromane - Benzopyran - 1-benzopyran - Dimethoxybenzene - M-dimethoxybenzene - Anisole - Phenoxy compound - Phenol ether - Tertiary aliphatic/aromatic amine - Dialkylarylamine - Methoxybenzene - Alkyl aryl ether - Monocyclic benzene moiety - Benzenoid - Tertiary amine - Imido ester - Oxacycle - Organoheterocyclic compound - Nitrile - Carbonitrile - Ether - Organic nitrogen compound - Organic oxygen compound - Amine - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Cyanide - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as neoflavans. These are neoflavonoids with a structure based on a 3,4-dihydro-4-aryl-2H-1-benzopyran skeleton.

External Descriptors

Not available

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