Structure Information
Structure

Compound Identification

SMILES

C[C@H]([C@H](C(=O)NC1=C(Cl)C=CC(CCC(O)=O)=C1)C1=CC=C(C=C1)C(C)(C)C)C(F)(F)F

InChIKey

InChIKey=JEMBRRBSPYQAHR-SZNDQCEHSA-N

Formula

C24H27ClF3NO3

Mass

469.93

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Phenylpropanoids and polyketides

Class

Phenylpropanoic acids

Subclass

Not available

Intermediate Tree Nodes

Not available

Direct Parent

Phenylpropanoic acids

Alternative Parents

Molecular Framework

Aromatic homomonocyclic compounds

Substituents

3-phenylpropanoic-acid - P-cymene - Aromatic monoterpenoid - Monoterpenoid - Monocyclic monoterpenoid - Phenylacetamide - Phenylpropane - Anilide - N-arylamide - Chlorobenzene - Halobenzene - Aryl halide - Monocyclic benzene moiety - Aryl chloride - Fatty amide - Benzenoid - Fatty acyl - Carboxamide group - Secondary carboxylic acid amide - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Carboxylic acid - Organohalogen compound - Organooxygen compound - Alkyl halide - Organonitrogen compound - Organofluoride - Alkyl fluoride - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organic oxygen compound - Organic nitrogen compound - Organochloride - Aromatic homomonocyclic compound

Description

This compound belongs to the class of organic compounds known as phenylpropanoic acids. These are compounds with a structure containing a benzene ring conjugated to a propanoic acid.

External Descriptors

Not available

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