Compound Identification
SMILES
CC(CC(=O)NC1=CC=C(NC2=CC=CC=C2)C=C1)=NNC(=O)C1=CC=CC=C1Cl
InChIKey
InChIKey=MHUOMBMCSPKBNE-UHFFFAOYSA-N
Formula
C23H21ClN4O2
Mass
420.9
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
2-halobenzoic acids and derivatives
Alternative Parents
Anilides Aniline and substituted anilines Benzoyl derivatives N-arylamides Chlorobenzenes Aryl chlorides Primary aromatic amines Fatty amides Vinylogous halides Secondary carboxylic acid amides Amino acids and derivatives Secondary amines Carbonyl compounds Hydrocarbon derivatives Organochlorides Organic oxides
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
2-halobenzoic acid or derivatives - Anilide - Benzoyl - Aniline or substituted anilines - N-arylamide - Chlorobenzene - Halobenzene - Aryl chloride - Aryl halide - Fatty acyl - Fatty amide - Primary aromatic amine - Vinylogous halide - Amino acid or derivatives - Carboxamide group - Secondary carboxylic acid amide - Secondary amine - Carboxylic acid derivative - Organohalogen compound - Hydrocarbon derivative - Amine - Carbonyl group - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Organochloride - Organonitrogen compound - Organooxygen compound - Aromatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as 2-halobenzoic acids and derivatives. These are benzoic acids or derivatives carrying a halogen atom at the 2-position of the benzene ring.
External Descriptors
Not available