Compound Identification
SMILES
O=C1OC[C@@H](C[S@@](=O)C2=CC=CC=C2)[C@H]1CC1=CC=CC=C1
InChIKey
InChIKey=HANBYKSFFUWADQ-LBUQITIBSA-N
Formula
C18H18O3S
Mass
314.4
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
Gamma butyrolactones Oxolanes Sulfoxides Carboxylic acid esters Sulfinyl compounds Oxacyclic compounds Monocarboxylic acids and derivatives Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Phenyl sulfoxide - Gamma butyrolactone - Oxolane - Sulfoxide - Lactone - Carboxylic acid ester - Oxacycle - Organoheterocyclic compound - Sulfinyl compound - Monocarboxylic acid or derivatives - Carboxylic acid derivative - Hydrocarbon derivative - Organosulfur compound - Organooxygen compound - Organic oxygen compound - Carbonyl group - Organic oxide - 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