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
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
- Subclass Benzoic acids and derivatives
-
Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
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
Benzamides Pyrrolo[2,3-d]pyrimidines Benzoyl derivatives Aniline and substituted anilines Fluorobenzenes Aminopyrimidines and derivatives 2-halopyrimidines N-methylpyrroles Imidolactams Aryl chlorides Aryl fluorides Heteroaromatic compounds Vinylogous amides Primary carboxylic acid amides Amino acids and derivatives Secondary amines Azacyclic compounds Hydrocarbon derivatives Organic oxides Organochlorides Organofluorides Organooxygen compounds
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