Structure Information
Structure

Compound Identification

SMILES

[Na+].[O-]C(=O)C1=CC=C(NC(=O)CCC2=CNN3C2=NC(=NC3=O)C(F)(F)F)C=C1

InChIKey

InChIKey=BFBILRJLFHWFGF-UHFFFAOYSA-M

Formula

C16H11F3N5NaO4

Mass

417.28

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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 heteropolycyclic compounds

Substituents

Acylaminobenzoic acid or derivatives - Benzoic acid - Pyrazolo[1,5-a][1,3,5]triazine - Pyrazolotriazine - Anilide - Benzoyl - N-arylamide - Triazinone - Fatty amide - 1,3,5-triazine - Triazine - Fatty acyl - Azole - Pyrazole - Heteroaromatic compound - Carboxamide group - Carboxylic acid salt - Secondary carboxylic acid amide - Organoheterocyclic compound - Organic metal halide - Carboxylic acid derivative - Carboxylic acid - Azacycle - Organic alkali metal salt - Organonitrogen compound - Organofluoride - Organohalogen compound - Organic oxide - Organic nitrogen compound - Alkyl halide - Organic salt - Alkyl fluoride - Carbonyl group - Organooxygen compound - Hydrocarbon derivative - Organic oxygen compound - Organic zwitterion - Organic sodium salt - Aromatic heteropolycyclic 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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