Compound Identification
SMILES
CCCCCCCCNC(=O)\C=C\SC(=O)C(OCC)C(=O)C1=CC=CC=C1
InChIKey
InChIKey=TWPINIJAXNKAHD-BMRADRMJSA-N
Formula
C22H31NO4S
Mass
405.55
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
Benzoyl derivatives Aryl alkyl ketones Monosaccharides 1,3-dicarbonyl compounds Acrylic acids and derivatives Thioesters Secondary carboxylic acid amides Carbothioic S-esters Sulfenyl compounds Dialkyl ethers Organonitrogen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Alkyl-phenylketone - Benzoyl - Aryl alkyl ketone - Monocyclic benzene moiety - Benzenoid - 1,3-dicarbonyl compound - Monosaccharide - Acrylic acid or derivatives - Carboxamide group - Carbothioic s-ester - Thiocarboxylic acid ester - Secondary carboxylic acid amide - Carboxylic acid derivative - Dialkyl ether - Ether - Sulfenyl compound - Thiocarboxylic acid or derivatives - Organic nitrogen compound - Organic oxide - Hydrocarbon derivative - Organonitrogen compound - 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