Structure Information
Structure

Compound Identification

SMILES

OC(=O)C1=CC=CC=C1NC(=O)C(=C\C1=CC=C(O1)C1=C(Cl)C=CC(=C1)[N+]([O-])=O)\C#N

InChIKey

InChIKey=MLHYMIKCHGPWBX-FMIVXFBMSA-N

Formula

C21H12ClN3O6

Mass

437.79

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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

Not available

Direct Parent

Acylaminobenzoic acid and derivatives

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Acylaminobenzoic acid or derivatives - Benzoic acid - Nitrobenzene - Anilide - Nitroaromatic compound - Benzoyl - N-arylamide - Chlorobenzene - Halobenzene - Aryl chloride - Aryl halide - Furan - Heteroaromatic compound - Vinylogous amide - Carboxamide group - C-nitro compound - Secondary carboxylic acid amide - Organic nitro compound - Organoheterocyclic compound - Organic 1,3-dipolar compound - Carboxylic acid derivative - Carboxylic acid - Carbonitrile - Nitrile - Propargyl-type 1,3-dipolar organic compound - Oxacycle - Organic oxoazanium - Allyl-type 1,3-dipolar organic compound - Organic oxide - Organic nitrogen compound - Carbonyl group - Organic oxygen compound - Organic salt - Organohalogen compound - Cyanide - Organochloride - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organic zwitterion - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as acylaminobenzoic acid and derivatives. These are derivatives of amino benzoic acid derivatives where the amine group is N-acylated.

External Descriptors

Not available

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