Structure Information
Structure

Compound Identification

SMILES

CC(C)(C)C(=O)C1=CNC2=C1N\C(C=N2)=C1\C=CC=CC1=O

InChIKey

InChIKey=LQKISJXVCCPYEI-BENRWUELSA-N

Formula

C17H17N3O2

Mass

295.342

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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

Aromatic heteropolycyclic compounds

Substituents

O-quinomethane - Aryl ketone - Aryl alkyl ketone - Substituted pyrrole - Pyrrole - Heteroaromatic compound - Vinylogous amide - Enamine - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Azacycle - Organoheterocyclic compound - Organic oxide - Organonitrogen compound - Hydrocarbon derivative - Amine - Imine - Organic nitrogen compound - Aromatic heteropolycyclic 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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