Structure Information
Structure

Compound Identification

SMILES

CC1=C(OCCC2=CC=CC=C2[N+]([O-])=O)C=C(C=C1)C(=O)N[C@@H](CCCN=C(N)N)C(N)=O

InChIKey

InChIKey=QIAJEISYCLBAPG-KRWDZBQOSA-N

Formula

C22H28N6O5

Mass

456.503

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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 - P-toluamide - Toluamide - Nitrobenzene - Phenoxy compound - Nitroaromatic compound - Benzoyl - Phenol ether - Alkyl aryl ether - Toluene - Fatty amide - Fatty acyl - Secondary carboxylic acid amide - Primary carboxylic acid amide - Carboxamide group - C-nitro compound - Organic nitro compound - Guanidine - Carboximidamide - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Allyl-type 1,3-dipolar organic compound - Organic oxoazanium - Carboxylic acid derivative - Ether - Organooxygen compound - Organic nitrogen compound - Organic oxygen compound - Organic salt - Organonitrogen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organic zwitterion - 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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