Compound Identification
SMILES
COC1=CC=C(C=C1)C(S(=O)C1=CC=CC=C1)C1(O)CCCCC1
InChIKey
InChIKey=ISQBNRUYIZCPMC-UHFFFAOYSA-N
Formula
C20H24O3S
Mass
344.47
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
- Subclass Benzyl sulfoxides
-
Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Benzyl sulfoxides
Intermediate Tree Nodes
Not available
Direct Parent
Benzyl sulfoxides
Alternative Parents
Phenyl sulfoxides Phenoxy compounds Methoxybenzenes Anisoles Cyclohexanols Alkyl aryl ethers Tertiary alcohols Sulfoxides Cyclic alcohols and derivatives Sulfinyl compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Benzyl sulfoxide - Phenyl sulfoxide - Phenoxy compound - Anisole - Methoxybenzene - Phenol ether - Alkyl aryl ether - Cyclohexanol - Cyclic alcohol - Tertiary alcohol - Sulfoxide - Ether - Sulfinyl compound - Organosulfur compound - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Alcohol - Aromatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as benzyl sulfoxides. These are organosulfur compounds that contain a sulfoxide group substituted by a benzyl group. They have the general structure RS(=O)R' ( R=benzyl, R'=organyl).
External Descriptors
Not available