Structure Information
Structure

Compound Identification

SMILES

CC1=CC(=C2OCC(CN3CCCCC3)(CC3=CC=C(Cl)C=C3)C(=O)C2=C1)[N+]([O-])=O

InChIKey

InChIKey=OGMNVPGKWIAGQD-UHFFFAOYSA-N

Formula

C23H25ClN2O4

Mass

428.91

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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 - Chromone - 1-benzopyran - Benzopyran - Chromane - Aryl ketone - Aryl alkyl ketone - Nitroaromatic compound - Alkyl aryl ether - Halobenzene - Chlorobenzene - Aralkylamine - Aryl halide - Aryl chloride - Benzenoid - Monocyclic benzene moiety - Piperidine - Tertiary aliphatic amine - Ketone - C-nitro compound - Tertiary amine - Organic nitro compound - Oxacycle - Azacycle - Organoheterocyclic compound - Ether - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Organic oxoazanium - Organic oxide - Organic oxygen compound - Organic salt - Hydrocarbon derivative - Organic nitrogen compound - Organohalogen compound - Amine - Organochloride - Organonitrogen compound - Organooxygen compound - Organic cation - 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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