Structure Information
Structure

Compound Identification

SMILES

COC1=C\C(C=CC1=O)=C1\C2=C(CCOC2)NC(N)=C1C#N

InChIKey

InChIKey=KNMIGGDWIXLTCM-OQLLNIDSSA-N

Formula

C16H15N3O3

Mass

297.314

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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

P-quinomethanes

Alternative Parents

Molecular Framework

Aliphatic heteropolycyclic compounds

Substituents

P-quinomethane - Dihydropyridine - Pyran - Ketene acetal or derivatives - Dialkyl ether - Ether - Carbonitrile - Nitrile - Organoheterocyclic compound - Azacycle - Oxacycle - Organic nitrogen compound - Organonitrogen compound - Organic oxide - Hydrocarbon derivative - Amine - Cyanide - Aliphatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as p-quinomethanes. These are organic compounds containing a benzene ring conjugated to a methylidene group and a ketone at carbon atoms 1 and 4, respectively.

External Descriptors

Not available

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