Structure Information
Structure

Compound Identification

SMILES

COC1=CC(C(=O)C=C1)=C1NC(N)=C(C#N)C(=C1)C(N)CC(C)C

InChIKey

InChIKey=OOVXDCSKJGYUMA-UHFFFAOYSA-N

Formula

C18H22N4O2

Mass

326.4

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organic oxygen compounds

Class

Organooxygen compounds

Subclass

Carbonyl compounds

Intermediate Tree Nodes

Ketones - Cyclic ketones - Quinomethanes

Direct Parent

O-quinomethanes

Alternative Parents

Molecular Framework

Aliphatic heteromonocyclic compounds

Substituents

O-quinomethane - Dihydropyridine - Hydropyridine - Vinylogous amide - Ketene acetal or derivatives - Carbonitrile - Nitrile - Azacycle - Organoheterocyclic compound - Hydrocarbon derivative - Amine - Primary aliphatic amine - Organic oxide - Organonitrogen compound - Primary amine - Organic nitrogen compound - Cyanide - Aliphatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as o-quinomethanes. These are organic compounds containing a benzene ring conjugated to a methylidene group and a ketone at carbon atoms 1 and 2, respectively.

External Descriptors

Not available

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