Structure Information
Structure

Compound Identification

SMILES

FC1=CC=CC(=C1)C(=O)N[C@@H](C1CCCCC1)C(=O)N1C[C@H](Cl)[C@H]2OCC(=O)[C@@H]12

InChIKey

InChIKey=DKBRLNKILYNVNQ-GDAAHCPNSA-N

Formula

C21H24ClFN2O4

Mass

422.88

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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 heteropolycyclic compounds

Substituents

N-acyl-alpha amino acid or derivatives - Hippuric acid or derivatives - Alpha-amino acid amide - Alpha-amino acid or derivatives - 3-halobenzoic acid or derivatives - Halobenzoic acid or derivatives - N-acylpyrrolidine - Furopyrrole - Benzoyl - Halobenzene - Fluorobenzene - Aryl fluoride - Aryl halide - 3-furanone - Tertiary carboxylic acid amide - Pyrrolidine - Oxolane - Amino acid or derivatives - Carboxamide group - Tertiary amine - Secondary carboxylic acid amide - Ketone - Oxacycle - Carboxylic acid derivative - Dialkyl ether - Organoheterocyclic compound - Azacycle - Ether - Organochloride - Organic nitrogen compound - Organic oxygen compound - Alkyl halide - Carbonyl group - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Alkyl chloride - Amine - Organonitrogen compound - Organofluoride - Organohalogen compound - Aromatic heteropolycyclic 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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