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Structure Information
Structure

Compound Identification

SMILES

COC1=C(OC)C=C(C=C1)C(=O)CN1C2=NC3=CC=CC=C3N2N=C(CCC([O-])=O)C1=O

InChIKey

InChIKey=AEWZLQMPHQVZPN-UHFFFAOYSA-M

Formula

C22H19N4O6

Mass

435.417

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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 - O-dimethoxybenzene - Dimethoxybenzene - Imidazo[1,2-a][1,2,4]triazine - Benzimidazole - Phenoxy compound - Anisole - Benzoyl - Phenol ether - Methoxybenzene - Aryl alkyl ketone - Alkyl aryl ether - Monocyclic benzene moiety - N-substituted imidazole - Triazine - Benzenoid - 1,2,4-triazine - Azole - Heteroaromatic compound - Imidazole - Carboxylic acid salt - Lactam - Ether - Carboxylic acid - Organoheterocyclic compound - Carboxylic acid derivative - Azacycle - Monocarboxylic acid or derivatives - Organic oxide - Organonitrogen compound - Hydrocarbon derivative - Organic nitrogen compound - Organic anion - 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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