Structure Information
Structure

Compound Identification

SMILES

CC(O)(C(F)F)C(NC(=O)C1=CC=C(C=C1)C#CC#CC1=CC=C(F)C=C1)C(=O)NO

InChIKey

InChIKey=QPGKCIHJUSVDCC-UHFFFAOYSA-N

Formula

C22H17F3N2O4

Mass

430.383

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Benzenoids

Class

Benzene and substituted derivatives

Subclass

Benzoic acids and derivatives

Intermediate Tree Nodes

Benzamides

Direct Parent

Hippuric acids and derivatives

Alternative Parents

Molecular Framework

Aromatic homomonocyclic compounds

Substituents

Hippuric acid or derivatives - N-acyl-alpha amino acid or derivatives - N-substituted-alpha-amino acid - Alpha-amino acid or derivatives - Benzoyl - Fluorobenzene - Halobenzene - Aryl fluoride - Aryl halide - Tertiary alcohol - Carboxamide group - Fluorohydrin - Halohydrin - Secondary carboxylic acid amide - Hydroxamic acid - Carboxylic acid derivative - Organofluoride - Hydrocarbon derivative - Organonitrogen compound - Carbonyl group - Organic oxide - Alkyl fluoride - Alcohol - Organohalogen compound - Alkyl halide - Organic nitrogen compound - Organic oxygen compound - Organooxygen compound - Aromatic homomonocyclic compound

Description

This compound belongs to the class of organic compounds known as hippuric acids and derivatives. These are compounds containing a hippuric acid or a derivative, with a structure characterized the presence of a benzoyl group linked to the N-terminal of a glycine.

External Descriptors

Not available

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