Structure Information
Structure

Compound Identification

SMILES

CCN(CC)C(=O)C1=C(F)C=CC(F)=C1C(=O)NC1(CCNCC1)C(=O)NCCNC(=O)C1=CC=C(Cl)C=C1

InChIKey

InChIKey=JSQIYUSKABXKQY-UHFFFAOYSA-N

Formula

C27H32ClF2N5O4

Mass

564.03

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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

N-acyl-alpha amino acid or derivatives - Hippuric acid or derivatives - Alpha-amino acid or derivatives - 2-halobenzoic acid or derivatives - 3-halobenzoic acid or derivatives - 4-halobenzoic acid or derivatives - Halobenzoic acid or derivatives - Piperidinecarboxamide - Benzoyl - Chlorobenzene - Fluorobenzene - Halobenzene - Aryl chloride - Piperidine - Aryl halide - Aryl fluoride - Tertiary carboxylic acid amide - Vinylogous halide - Amino acid or derivatives - Carboxamide group - Secondary carboxylic acid amide - Azacycle - Carboxylic acid derivative - Secondary amine - Organoheterocyclic compound - Secondary aliphatic amine - Organofluoride - Organic nitrogen compound - Organooxygen compound - Amine - Carbonyl group - Organonitrogen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organohalogen compound - Organochloride - 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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