Structure Information
Structure

Compound Identification

SMILES

CC1=NC(Cl)=C(C=C1)C(=O)C(C(O)=O)=C(NC1=CC=CC=C1)NC1=CC=CC=C1

InChIKey

InChIKey=GQLOHJCDHYZALQ-UHFFFAOYSA-N

Formula

C22H18ClN3O3

Mass

407.85

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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

Direct Parent

Aryl ketones

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Aryl ketone - 2-halopyridine - Methylpyridine - Beta-keto acid - Keto acid - Aryl chloride - Aryl halide - Beta-hydroxy ketone - Monocyclic benzene moiety - Pyridine - Benzenoid - Alpha-branched alpha,beta-unsaturated-ketone - Acryloyl-group - Alpha,beta-unsaturated ketone - Vinylogous halide - Vinylogous amide - Heteroaromatic compound - Enone - Ketene acetal or derivatives - Azacycle - Organoheterocyclic compound - Carboxylic acid derivative - Carboxylic acid - Monocarboxylic acid or derivatives - Organonitrogen compound - Organic oxide - Hydrocarbon derivative - Organochloride - Organohalogen compound - Organic nitrogen compound - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as aryl ketones. These are organic aromatic compounds that contain a ketone group substituted at one C-atom with an aryl group. They have the generic structure RC(=O)R', where R = aryl group and R'=organyl group.

External Descriptors

Not available

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