Compound Identification
SMILES
OC(=O)C1C(SC23C=CC=CC2=NCCC13)C(=O)C1=CC=CC=C1Cl
InChIKey
InChIKey=LPQHWZFPDXUIJZ-UHFFFAOYSA-N
Formula
C19H16ClNO3S
Mass
373.85
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
Aryl alkyl ketones Gamma-keto acids and derivatives Benzoyl derivatives Tetrahydropyridines Chlorobenzenes Aryl chlorides Vinylogous halides Thiolanes Ketimines Propargyl-type 1,3-dipolar organic compounds Monocarboxylic acids and derivatives Azacyclic compounds Dialkylthioethers Carboxylic acids Hydrocarbon derivatives Organic oxides Organochlorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alkyl-phenylketone - Benzoyl - Gamma-keto acid - Aryl alkyl ketone - Chlorobenzene - Halobenzene - Tetrahydropyridine - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Benzenoid - Keto acid - Vinylogous halide - Thiolane - Ketimine - Azacycle - Carboxylic acid derivative - Carboxylic acid - Organoheterocyclic compound - Dialkylthioether - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Thioether - Monocarboxylic acid or derivatives - Organic nitrogen compound - Imine - Organic oxide - Hydrocarbon derivative - Organohalogen compound - Organochloride - Organonitrogen compound - Aromatic heteropolycyclic 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