Compound Identification
SMILES
CCOC(=O)O[C@@H]1CCN([C@H]1C1(CC1)[S@](=O)C1=CC=C(C)C=C1)C(=O)OCC
InChIKey
InChIKey=QYQQHGIMEABPGX-FGHSDJDKSA-N
Formula
C20H27NO6S
Mass
409.5
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
Pyrrolidine carboxylic acids Toluenes Carbonic acid diesters Carbamate esters Sulfoxides Sulfinyl compounds Azacyclic compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Phenyl sulfoxide - Pyrrolidine carboxylic acid - Pyrrolidine carboxylic acid or derivatives - Toluene - Carbonic acid diester - Pyrrolidine - Carbamic acid ester - Carbonic acid derivative - Sulfoxide - Azacycle - Organoheterocyclic compound - Sulfinyl compound - Hydrocarbon derivative - Organic oxide - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organic oxygen compound - Organic nitrogen compound - Carbonyl group - Aromatic heteromonocyclic 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