Compound Identification
SMILES
CCC(CC)(C1=CC=C(S1)C(=O)OC)C1=CC(C(C)C)=C(OCC(O)C(C)(C)C)C=C1
InChIKey
InChIKey=JDHNXJVSBFOZRZ-UHFFFAOYSA-N
Formula
C26H38O4S
Mass
446.65
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
- Subclass Cumenes
-
Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Cumenes
Intermediate Tree Nodes
Not available
Direct Parent
Cumenes
Alternative Parents
Phenylpropanes Thiophene carboxylic acids and derivatives Phenoxy compounds Phenol ethers Alkyl aryl ethers 2,5-disubstituted thiophenes Methyl esters Heteroaromatic compounds Secondary alcohols Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Cumene - Phenylpropane - Phenoxy compound - Phenol ether - Thiophene carboxylic acid or derivatives - Alkyl aryl ether - 2,5-disubstituted thiophene - Heteroaromatic compound - Methyl ester - Thiophene - Carboxylic acid ester - Secondary alcohol - Ether - Carboxylic acid derivative - Organoheterocyclic compound - Hydrocarbon derivative - Organooxygen compound - Organic oxide - Alcohol - Organic oxygen compound - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as cumenes. These are aromatic compounds containing a prop-2-ylbenzene moiety.
External Descriptors
Not available