Compound Identification
SMILES
CC1=C2C(=NC(C=C2C(F)(F)F)=C2C=CC(=O)C=C2)N(CC2=CC(Cl)=CC=C2)N1
InChIKey
InChIKey=NXRHWROSDMRROP-UHFFFAOYSA-N
Formula
C21H15ClF3N3O
Mass
417.82
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organic oxygen compounds
-
Class
Organooxygen compounds
-
Subclass
Carbonyl compounds
-
Level 5
Ketones
-
Level 6
Cyclic ketones
-
Level 7
Quinomethanes
- Level 8 P-quinomethanes
-
Level 7
Quinomethanes
-
Level 6
Cyclic ketones
-
Level 5
Ketones
-
Subclass
Carbonyl compounds
-
Class
Organooxygen compounds
-
Superclass
Organic oxygen compounds
Kingdom
Organic compounds
Superclass
Organic oxygen compounds
Class
Organooxygen compounds
Subclass
Carbonyl compounds
Intermediate Tree Nodes
Ketones - Cyclic ketones - Quinomethanes
Direct Parent
P-quinomethanes
Alternative Parents
Chlorobenzenes Pyridines and derivatives Imidolactams Aryl chlorides Heteroaromatic compounds Azacyclic compounds Alkylhydrazines Organofluorides Organochlorides Organic oxides Hydrocarbon derivatives Alkyl fluorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
P-quinomethane - Chlorobenzene - Halobenzene - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Imidolactam - Benzenoid - Pyridine - Heteroaromatic compound - Alkylhydrazine - Azacycle - Organoheterocyclic compound - Organochloride - Organohalogen compound - Hydrazine derivative - Alkyl halide - Hydrocarbon derivative - Organic oxide - Alkyl fluoride - Organic nitrogen compound - Organofluoride - Organonitrogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as p-quinomethanes. These are organic compounds containing a benzene ring conjugated to a methylidene group and a ketone at carbon atoms 1 and 4, respectively.
External Descriptors
Not available