Compound Identification
SMILES
CC(O)=O.CC(CCC1=CC=CC=C1)NCC(O)C1=CC(=C(O)C=C1)S(C)=O
InChIKey
InChIKey=IUYWHTDLLFDIAZ-UHFFFAOYSA-N
Formula
C21H29NO5S
Mass
407.53
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
- Subclass Phenyl sulfoxides
-
Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Phenyl sulfoxides
Intermediate Tree Nodes
Not available
Direct Parent
Phenyl sulfoxides
Alternative Parents
Aralkylamines 1-hydroxy-2-unsubstituted benzenoids Sulfoxides Secondary alcohols 1,2-aminoalcohols Sulfinyl compounds Monocarboxylic acids and derivatives Dialkylamines Carboxylic acids Organic oxides Hydrocarbon derivatives Carbonyl compounds Aromatic alcohols
Molecular Framework
Not available
Substituents
Phenyl sulfoxide - Phenol - Aralkylamine - 1-hydroxy-2-unsubstituted benzenoid - 1,2-aminoalcohol - Secondary alcohol - Sulfoxide - Carboxylic acid derivative - Carboxylic acid - Secondary aliphatic amine - Monocarboxylic acid or derivatives - Secondary amine - Sulfinyl compound - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organic oxygen compound - Amine - Organic oxide - Hydrocarbon derivative - Carbonyl group - Alcohol - Aromatic alcohol - Organic nitrogen compound - Aromatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as phenyl sulfoxides. These are organosulfur compounds containing a sulfoxide group substituted with a phenyl group.
External Descriptors
Not available