Structure Information
Structure

Compound Identification

SMILES

O[C@H]1CN(C[C@@H]1NC(=O)CNC(=O)C1=CC(=CC=C1)C(F)(F)F)C1CCC(CC1)N1C=CC(=N1)C(F)(F)F

InChIKey

InChIKey=PQVIAQWKWIGTMJ-BTRQGYIVSA-N

Formula

C24H27F6N5O3

Mass

547.502

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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 heteromonocyclic compounds

Substituents

Hippuric acid or derivatives - N-acyl-alpha amino acid or derivatives - Alpha-amino acid amide - Trifluoromethylbenzene - N-substituted-alpha-amino acid - Alpha-amino acid or derivatives - Benzoyl - Cyclohexylamine - N-alkylpyrrolidine - Heteroaromatic compound - Azole - Pyrazole - Pyrrolidine - 1,2-aminoalcohol - Carboxamide group - Tertiary aliphatic amine - Secondary alcohol - Secondary carboxylic acid amide - Amino acid or derivatives - Tertiary amine - Carboxylic acid derivative - Azacycle - Organoheterocyclic compound - Organic nitrogen compound - Organohalogen compound - Carbonyl group - Organofluoride - Organonitrogen compound - Organooxygen compound - Amine - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Alkyl halide - Alkyl fluoride - Alcohol - Aromatic heteromonocyclic 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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