Structure Information
Structure

Compound Identification

SMILES

CCOC(=O)[C@H](C(=O)C1=CC=CC=C1)C1=C(N)C(OCC)=NC(C)=N1

InChIKey

InChIKey=UBHWHHOXMGGYFB-ZDUSSCGKSA-N

Formula

C18H21N3O4

Mass

343.383

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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 heteromonocyclic compounds

Substituents

Alkyl-phenylketone - Benzoyl - Aryl alkyl ketone - Alkyl aryl ether - Aminopyrimidine - Beta-keto acid - Fatty acid ester - Monocyclic benzene moiety - Keto acid - Pyrimidine - 1,3-dicarbonyl compound - Benzenoid - Fatty acyl - Heteroaromatic compound - Carboxylic acid ester - Amino acid or derivatives - Monocarboxylic acid or derivatives - Ether - Carboxylic acid derivative - Azacycle - Organoheterocyclic compound - Primary amine - Organonitrogen compound - Amine - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organic nitrogen compound - Aromatic heteromonocyclic 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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