Structure Information
Structure

Compound Identification

SMILES

CN(C)C1=CC=C(CN(CCC2=CNC3=CC=CC=C23)C(=O)CN(CC2=CC=CC=C2)C(=O)C2=CC(C)=CC=C2)C=C1

InChIKey

InChIKey=PQQBXCZOBNKTIC-UHFFFAOYSA-N

Formula

C36H38N4O2

Mass

558.726

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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

Hippuric acid or derivatives - N,n-dialkyl-m-toluamide - Alpha-amino acid or derivatives - 3-alkylindole - M-toluamide - Toluamide - Indole - Indole or derivatives - Benzoyl - Aniline or substituted anilines - Dialkylarylamine - Tertiary aliphatic/aromatic amine - Toluene - Substituted pyrrole - Heteroaromatic compound - Pyrrole - Tertiary carboxylic acid amide - Carboxamide group - Tertiary amine - Amino acid or derivatives - Azacycle - Carboxylic acid derivative - Organoheterocyclic compound - Amine - Organooxygen compound - Organonitrogen compound - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Carbonyl group - Organic oxygen 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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