Compound Identification
SMILES
CS(O)(=O)=O.CCCC1=CC=C(CCC)C=C1
InChIKey
InChIKey=XSTGRGQELNWREZ-UHFFFAOYSA-N
Formula
C13H22O3S
Mass
258.38
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
- Subclass Phenylpropanes
-
Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Phenylpropanes
Intermediate Tree Nodes
Not available
Direct Parent
Phenylpropanes
Alternative Parents
Sulfonyls Organosulfonic acids Methanesulfonates Aromatic hydrocarbons Alkanesulfonic acids Unsaturated hydrocarbons Organic oxides Hydrocarbon derivatives
Molecular Framework
Not available
Substituents
Phenylpropane - Aromatic hydrocarbon - Alkanesulfonic acid - Sulfonyl - Organosulfonic acid - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Methanesulfonate - Organic oxygen compound - Unsaturated hydrocarbon - Organic oxide - Hydrocarbon derivative - Organosulfur compound - Hydrocarbon - Aromatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as phenylpropanes. These are organic compounds containing a phenylpropane moiety.
External Descriptors
Not available