Compound Identification
SMILES
CC(C(SC(C)=O)C(=O)C1=CC=CC=C1)C(=O)[N+]1(CCC[C@H]1C)C(O)=O
InChIKey
InChIKey=FRMZGHBFWDWPGQ-NEIORYIFSA-O
Formula
C19H24NO5S
Mass
378.46
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 Pyrrolidine carboxylic acids N-acylpyrrolidines Benzoyl derivatives Aryl alkyl ketones Quaternary ammonium salts Thioesters Carbothioic S-esters Carbamic acids and derivatives Sulfenyl compounds Azacyclic compounds Organic oxides Hydrocarbon derivatives Organic cations
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Alkyl-phenylketone - Butyrophenone - Benzoyl - N-acylpyrrolidine - Pyrrolidine carboxylic acid - Pyrrolidine carboxylic acid or derivatives - Aryl alkyl ketone - Monocyclic benzene moiety - Benzenoid - Pyrrolidine - Quaternary ammonium salt - Carbamic acid derivative - Carbothioic s-ester - Thiocarboxylic acid ester - Organoheterocyclic compound - Azacycle - Carboxylic acid derivative - Sulfenyl compound - Thiocarboxylic acid or derivatives - Organic nitrogen compound - Organosulfur compound - Organonitrogen compound - Hydrocarbon derivative - Organic oxide - Organic cation - Aromatic heteromonocyclic 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