Compound Identification
SMILES
OC(C(CC1=CC=CC=C1)NC(=S)CCC(=O)C1=CC=CC=C1)C(O)=O
InChIKey
InChIKey=QIEHHECWJCIRJN-UHFFFAOYSA-N
Formula
C20H21NO4S
Mass
371.45
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
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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
Beta amino acids and derivatives Butyrophenones Amphetamines and derivatives Aryl alkyl ketones Benzoyl derivatives Alpha hydroxy acids and derivatives Monosaccharides Thioamides Secondary alcohols Carboxylic acids Monocarboxylic acids and derivatives Thiocarboxylic acid amides Organic oxides Organonitrogen compounds Thiocarbonyl compounds Hydrocarbon derivatives
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Alkyl-phenylketone - Beta amino acid or derivatives - Butyrophenone - Amphetamine or derivatives - Benzoyl - Aryl alkyl ketone - Alpha-hydroxy acid - Monocyclic benzene moiety - Benzenoid - Hydroxy acid - Monosaccharide - Thioamide - Secondary alcohol - Monocarboxylic acid or derivatives - Carboxylic acid - Carboxylic acid derivative - Thiocarboxylic acid amide - Organonitrogen compound - Alcohol - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organosulfur compound - Thiocarbonyl group - 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