Structure Information
Structure

Compound Identification

SMILES

COC1=C(C=C(C=NNC(=O)C(NC(=O)C2=C(Cl)C=C(Cl)C=C2)C(C)C)C=C1)[N+]([O-])=O

InChIKey

InChIKey=CZVQSVWTXHVCEH-UHFFFAOYSA-N

Formula

C20H20Cl2N4O5

Mass

467.3

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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

N-acyl-alpha amino acid or derivatives - Hippuric acid or derivatives - Valine or derivatives - Nitrophenyl ether - 2-halobenzoic acid or derivatives - 4-halobenzoic acid or derivatives - Halobenzoic acid or derivatives - Alpha-amino acid or derivatives - N-substituted-alpha-amino acid - Methoxyaniline - Nitrobenzene - Methoxybenzene - Benzoyl - 1,3-dichlorobenzene - Phenoxy compound - Anisole - Nitroaromatic compound - Phenol ether - Chlorobenzene - Halobenzene - Alkyl aryl ether - Aryl halide - Aryl chloride - Vinylogous halide - Organic nitro compound - Carboxamide group - Secondary carboxylic acid amide - C-nitro compound - Organic oxoazanium - Carboxylic acid derivative - Organic 1,3-dipolar compound - Allyl-type 1,3-dipolar organic compound - Ether - Propargyl-type 1,3-dipolar organic compound - Organochloride - Organic zwitterion - Organic oxide - Organic oxygen compound - Carbonyl group - Organic salt - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Organohalogen compound - Hydrocarbon derivative - 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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