Structure Information
Structure

Compound Identification

SMILES

CC1=NC2=C(N1)C(=O)\C(C=C2Cl)=C1/NC=C(CC2=CC=C(F)C=C2)N1

InChIKey

InChIKey=BRBXJCRFAMQTFQ-QGOAFFKASA-N

Formula

C18H14ClFN4O

Mass

356.79

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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

Aryl ketone - O-quinomethane - Fluorobenzene - Halobenzene - Aryl fluoride - Aryl halide - Monocyclic benzene moiety - Benzenoid - Azole - Heteroaromatic compound - Imidazole - Vinylogous amide - 4-imidazoline - Ketene acetal or derivatives - Azacycle - Enamine - Chloroalkene - Haloalkene - Organoheterocyclic compound - Vinyl halide - Vinyl chloride - Organic oxide - Organic nitrogen compound - Hydrocarbon derivative - Amine - Organonitrogen compound - Organohalogen compound - Organochloride - Organofluoride - 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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