Structure Information
Structure

Compound Identification

SMILES

CC1=CC(C(=O)COC(=O)C2=NNC(=O)CC2)=C(C)N1CC1=CC=CC=C1Cl

InChIKey

InChIKey=WPKYKTNNGNGNCG-UHFFFAOYSA-N

Formula

C20H20ClN3O4

Mass

401.85

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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

Direct Parent

Aryl alkyl ketones

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Aryl alkyl ketone - Chlorobenzene - Halobenzene - Pyridazinone - Alpha-acyloxy ketone - Monocyclic benzene moiety - Aryl chloride - Benzenoid - Substituted pyrrole - Aryl halide - Pyridazine - Heteroaromatic compound - Vinylogous amide - Pyrrole - Carboxylic acid ester - Monocarboxylic acid or derivatives - Carboxylic acid derivative - Azacycle - Organoheterocyclic compound - Organochloride - Organohalogen compound - Organic nitrogen compound - Organic oxide - Hydrocarbon derivative - Organonitrogen compound - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as aryl alkyl ketones. These are ketones have the generic structure RC(=O)R', where R = aryl group and R'=alkyl group.

External Descriptors

Not available

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