Compound Identification
SMILES
CC1=CC=C(C=C1)S(=O)(=O)C(CCC(=O)C1=CC=C(Cl)C=C1)C#N
InChIKey
InChIKey=WBQSPYVBUHEACH-UHFFFAOYSA-N
Formula
C18H16ClNO3S
Mass
361.84
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organic oxygen compounds
-
Class
Organooxygen compounds
-
Subclass
Carbonyl compounds
-
Level 5
Ketones
-
Level 6
Aryl ketones
-
Level 7
Phenylketones
- Level 8 Alkyl-phenylketones
-
Level 7
Phenylketones
-
Level 6
Aryl 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 - Aryl ketones - Phenylketones
Direct Parent
Alkyl-phenylketones
Alternative Parents
Butyrophenones Tosyl compounds Benzenesulfonyl compounds Benzoyl derivatives Aryl alkyl ketones Chlorobenzenes Aryl chlorides Sulfones Nitriles Organochlorides Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Alkyl-phenylketone - Butyrophenone - Tosyl compound - Benzenesulfonyl group - Benzoyl - Aryl alkyl ketone - Chlorobenzene - Halobenzene - Toluene - Aryl halide - Benzenoid - Monocyclic benzene moiety - Aryl chloride - Sulfonyl - Sulfone - Carbonitrile - Nitrile - Hydrocarbon derivative - Organohalogen compound - Organochloride - Cyanide - Organic nitrogen compound - Organonitrogen compound - Organic oxide - Organosulfur compound - Aromatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as alkyl-phenylketones. These are aromatic compounds containing a ketone substituted by one alkyl group, and a phenyl group.
External Descriptors
Not available