Structure Information
Structure

Compound Identification

SMILES

NC1=NC(=O)N(C=C1)[C@@H]1O[C@H](C(O)C2=CC=CC=C2C([O-])=O)[C@](O)(C2=CC=CC=C2C([O-])=O)C1(F)F

InChIKey

InChIKey=FLEGKVSBDHUCTC-RTIVQEIQSA-L

Formula

C23H17F2N3O8

Mass

501.4

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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

Benzoic acids

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Benzoic acid - Benzoyl - Aminopyrimidine - Pyrimidone - Imidolactam - Hydropyrimidine - Pyrimidine - Heteroaromatic compound - Oxolane - Tertiary alcohol - Amino acid or derivatives - Amino acid - Carboxylic acid salt - Fluorohydrin - Halohydrin - Secondary alcohol - Carboxylic acid derivative - Oxacycle - Carboxylic acid - Azacycle - Organoheterocyclic compound - Organohalogen compound - Organic nitrogen compound - Amine - Alkyl halide - Alkyl fluoride - Alcohol - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organofluoride - Organonitrogen compound - Organooxygen compound - Aromatic alcohol - Primary amine - Organic anion - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as benzoic acids. These are organic Compounds containing a benzene ring which bears at least one carboxyl group.

External Descriptors

Not available

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