Compound Identification
SMILES
CC1=CC=C(C=C1)C(=O)N1N=C(N=C1NCC1=CC=C(Cl)C=C1)C1=CC=CO1
InChIKey
InChIKey=JLHAWXRBUHZIGV-UHFFFAOYSA-N
Formula
C21H17ClN4O2
Mass
392.84
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
Not available
Direct Parent
Benzoic acids and derivatives
Alternative Parents
p-Toluamides Benzylamines Benzoyl derivatives Chlorobenzenes Aryl chlorides Triazoles Heteroaromatic compounds Furans Oxacyclic compounds Azacyclic compounds Organooxygen compounds Organochlorides Organic oxides Hydrocarbon derivatives Amines
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
P-toluamide - Toluamide - Benzoic acid or derivatives - Benzoyl - Benzylamine - Chlorobenzene - Toluene - Halobenzene - Aryl chloride - Aryl halide - Azole - Heteroaromatic compound - 1,2,4-triazole - Furan - Oxacycle - Azacycle - Organoheterocyclic compound - Organooxygen compound - Organic nitrogen compound - Amine - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organonitrogen compound - Organohalogen compound - Organochloride - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as benzoic acids and derivatives. These are organic compounds containing a carboxylic acid substituent attached to a benzene ring.
External Descriptors
Not available