Compound Identification
SMILES
CC1=CC=C(C=C1)S(=O)(=O)[C@@]1(O[C@H]1CO)[C@H](O)C1=CC=CC=C1
InChIKey
InChIKey=QNABUBYZWUPWHK-GVDBMIGSSA-N
Formula
C17H18O5S
Mass
334.39
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
-
Subclass
Toluenes
- Level 5 Tosyl compounds
-
Subclass
Toluenes
-
Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Toluenes
Intermediate Tree Nodes
Not available
Direct Parent
Tosyl compounds
Alternative Parents
Benzenesulfonyl compounds Sulfones Monothioacetals Secondary alcohols Oxacyclic compounds Epoxides Primary alcohols Organic oxides Hydrocarbon derivatives Aromatic alcohols
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Tosyl compound - Benzenesulfonyl group - Monothioacetal - Sulfone - Sulfonyl - Secondary alcohol - Oxirane - Oxacycle - Organoheterocyclic compound - Hydrocarbon derivative - Organic oxide - Primary alcohol - Organosulfur compound - Organooxygen compound - Organic oxygen compound - Aromatic alcohol - Alcohol - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as tosyl compounds. These are organosulfur compounds containing a tosyl group, with the general formula CH3C6H4S(O2)R (R = any atom).
External Descriptors
Not available