Structure Information
Structure

Compound Identification

SMILES

CC1=C(C#N)C2=NC3=CC=CC=C3N2C(=O)C1=CNC1=CC=CC=C1C([O-])=O

InChIKey

InChIKey=NNBYJCMSUDXSNN-UHFFFAOYSA-M

Formula

C21H13N4O3

Mass

369.361

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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

Aminobenzoic acids and derivatives

Direct Parent

Aminobenzoic acids

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Aminobenzoic acid - Benzimidazole - Imidazo[1,2-a]pyridine - Benzoic acid - Benzoyl - Aniline or substituted anilines - Methylpyridine - Pyridinone - N-substituted imidazole - Pyridine - Azole - Heteroaromatic compound - Imidazole - Vinylogous amide - Carboxylic acid salt - Lactam - Nitrile - Carbonitrile - Organoheterocyclic compound - Azacycle - Carboxylic acid - Carboxylic acid derivative - Organonitrogen compound - Organic nitrogen compound - Amine - Hydrocarbon derivative - Organic oxide - Cyanide - Organic oxygen compound - Organooxygen compound - Organic anion - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as aminobenzoic acids. These are benzoic acids containing an amine group attached to the benzene moiety.

External Descriptors

Not available

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