Structure Information
Structure

Compound Identification

SMILES

CN1C=CC2=C1N=C(Cl)N=C2NC1=C(C=CC(F)=C1)C(N)=O

InChIKey

InChIKey=NFQKXGYABHADGR-UHFFFAOYSA-N

Formula

C14H11ClFN5O

Mass

319.72

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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

Halobenzoic acids and derivatives

Direct Parent

4-halobenzoic acids and derivatives

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

4-halobenzoic acid or derivatives - Pyrrolo[2,3-d]pyrimidine - Pyrrolopyrimidine - Benzamide - Aniline or substituted anilines - Benzoyl - Aminopyrimidine - Halopyrimidine - 2-halopyrimidine - Halobenzene - Fluorobenzene - N-methylpyrrole - Aryl chloride - Aryl fluoride - Imidolactam - Substituted pyrrole - Aryl halide - Pyrimidine - Pyrrole - Vinylogous amide - Heteroaromatic compound - Amino acid or derivatives - Carboxamide group - Primary carboxylic acid amide - Secondary amine - Carboxylic acid derivative - Organoheterocyclic compound - Azacycle - Organonitrogen compound - Organooxygen compound - Organic nitrogen compound - Amine - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organohalogen compound - Organochloride - Organofluoride - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as 4-halobenzoic acids and derivatives. These are benzoic acids or derivatives carrying a halogen atom at the 4-position of the benzene ring.

External Descriptors

Not available

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