Structure Information
Structure

Compound Identification

SMILES

COC1=CC=C(CN[C@@H](CC(=O)C2=CC=C(Cl)C=C2)C(O)=O)C=C1

InChIKey

InChIKey=ZWZVZHFZJWPMDD-INIZCTEOSA-N

Formula

C18H18ClNO4

Mass

347.8

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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 homomonocyclic compounds

Substituents

Alkyl-phenylketone - Butyrophenone - Alpha-amino acid - Alpha-amino acid or derivatives - L-alpha-amino acid - Phenoxy compound - Anisole - Benzoyl - Benzylamine - Gamma-keto acid - Phenol ether - Phenylmethylamine - Aryl alkyl ketone - Methoxybenzene - Aralkylamine - Halobenzene - Alkyl aryl ether - Chlorobenzene - Aryl halide - Aryl chloride - Benzenoid - Monocyclic benzene moiety - Keto acid - Beta-aminoketone - Amino acid - Amino acid or derivatives - Carboxylic acid derivative - Ether - Monocarboxylic acid or derivatives - Secondary amine - Carboxylic acid - Secondary aliphatic amine - Organopnictogen compound - Amine - Hydrocarbon derivative - Organohalogen compound - Organochloride - Organonitrogen compound - Organic nitrogen compound - Organic oxide - Aromatic homomonocyclic 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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