Compound Identification
SMILES
CCO[C@@H]1OC(=O)[C@]2(CC=C([C@@H]12)C(=O)OCC)[S@@](=O)C1=CC=C(C)C=C1
InChIKey
InChIKey=UYKFRSIMXLCTSU-VJGYECMLSA-N
Formula
C19H22O6S
Mass
378.44
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
Toluenes Gamma butyrolactones Dicarboxylic acids and derivatives Oxolanes Enoate esters Sulfoxides Sulfinyl compounds Oxacyclic compounds Acetals Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Phenyl sulfoxide - Toluene - Dicarboxylic acid or derivatives - Gamma butyrolactone - Oxolane - Enoate ester - Alpha,beta-unsaturated carboxylic ester - Carboxylic acid ester - Lactone - Sulfoxide - Acetal - Carboxylic acid derivative - Oxacycle - Sulfinyl compound - Organoheterocyclic compound - Carbonyl group - Hydrocarbon derivative - Organosulfur compound - Organooxygen compound - Organic oxide - Organic oxygen compound - Aromatic heteropolycyclic 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