Structure Information
Structure

Compound Identification

SMILES

CCOC(=O)[C@H](C(=O)CCl)C(=N)C(F)(F)F

InChIKey

InChIKey=AXCPWWWYVZBUPU-RXMQYKEDSA-N

Formula

C8H9ClF3NO3

Mass

259.61

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organic acids and derivatives

Class

Keto acids and derivatives

Subclass

Beta-keto acids and derivatives

Intermediate Tree Nodes

Not available

Direct Parent

Beta-keto acids and derivatives

Alternative Parents

Molecular Framework

Aliphatic acyclic compounds

Substituents

Beta-keto acid - Fatty acid ester - Fatty acyl - 1,3-dicarbonyl compound - Alpha-haloketone - Alpha-chloroketone - Carboxylic acid ester - Ketimine - Ketone - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Organochloride - Organohalogen compound - Alkyl chloride - Organooxygen compound - Hydrocarbon derivative - Imine - Organic oxide - Organic oxygen compound - Carbonyl group - Organic nitrogen compound - Alkyl halide - Alkyl fluoride - Organofluoride - Organonitrogen compound - Aliphatic acyclic compound

Description

This compound belongs to the class of organic compounds known as beta-keto acids and derivatives. These are organic compounds containing an aldehyde substituted with a keto group on the C3 carbon atom.

External Descriptors

Not available

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