Structure Information
Structure

Compound Identification

SMILES

OC(=O)C1=CC=CC(=C1)C1=CC=C(O1)C=NNC1=NC2=NON=C2N=C1NC1=CC=C(F)C=C1

InChIKey

InChIKey=PJFPFNLJMAFULO-UHFFFAOYSA-N

Formula

C22H14FN7O4

Mass

459.397

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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 heteropolycyclic compounds

Substituents

Benzoic acid - Benzoyl - Aniline or substituted anilines - Aminopyrazine - Fluorobenzene - Halobenzene - Aryl fluoride - Aryl halide - Imidolactam - Pyrazine - Azole - Heteroaromatic compound - Furan - Oxadiazole - Furazan - Oxacycle - Carboxylic acid derivative - Carboxylic acid - Azacycle - Organoheterocyclic compound - Hydrazone - Monocarboxylic acid or derivatives - Organopnictogen compound - Organic oxygen compound - Organic oxide - Organooxygen compound - Organonitrogen compound - Hydrocarbon derivative - Organic nitrogen compound - Organohalogen compound - Organofluoride - Aromatic heteropolycyclic 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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