Structure Information
Structure

Compound Identification

SMILES

NC1=NN=C2N=C(C(C(=O)C3=CC=CC=C3Cl)C3=NC4=NN=C(N)N4NC3=O)C(=O)NN12

InChIKey

InChIKey=GBHLWOWKHNDSEW-UHFFFAOYSA-N

Formula

C16H11ClN12O3

Mass

454.8

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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 - Aryl ketones - Phenylketones

Direct Parent

Alkyl-phenylketones

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Alkyl-phenylketone - Benzoyl - Aryl alkyl ketone - Chlorobenzene - Halobenzene - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Triazine - Benzenoid - 1,2,4-triazine - Azole - 1,2,4-triazole - Heteroaromatic compound - Vinylogous halide - Lactam - Azacycle - Organoheterocyclic compound - Primary amine - Organohalogen compound - Organic oxide - Organopnictogen compound - Organic nitrogen compound - Hydrocarbon derivative - Organochloride - Organonitrogen compound - Amine - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as alkyl-phenylketones. These are aromatic compounds containing a ketone substituted by one alkyl group, and a phenyl group.

External Descriptors

Not available

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