Structure Information
Structure

Compound Identification

SMILES

CCCCCCCCCCCCCOC1=CC(=O)C(C=C1)=C1N=C2NC2=N1

InChIKey

InChIKey=FPXNVQBVLVQUSC-UHFFFAOYSA-N

Formula

C22H31N3O2

Mass

369.509

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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 heteropolycyclic compounds

Substituents

O-quinomethane - Triazine - Imidolactam - 1,3,5-triazine - Vinylogous ester - Ketene acetal or derivatives - Amidine - Aziridine - Carboximidamide - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Azacycle - Organoheterocyclic compound - Hydrocarbon derivative - Amine - Organic nitrogen compound - Organic oxide - Organonitrogen compound - Aliphatic 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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