Compound Identification
SMILES
COC(=O)[C@@]12CC(COS(C)(=O)=O)O[C@@]1(C1=CC=CC=C1C2)C1=CC=CC=C1
InChIKey
InChIKey=LQNJUBZLONIKRS-LTGQRPFBSA-N
Formula
C21H22O6S
Mass
402.46
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
- Class Indanes
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Indanes
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Indanes
Alternative Parents
Sulfonic acid esters Organosulfonic acid esters Benzene and substituted derivatives Sulfonyls Oxolanes Methyl esters Methanesulfonates Oxacyclic compounds Monocarboxylic acids and derivatives Dialkyl ethers Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Indane - Monocyclic benzene moiety - Sulfonic acid ester - Organosulfonic acid ester - Methanesulfonate - Oxolane - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Sulfonyl - Methyl ester - Carboxylic acid ester - Monocarboxylic acid or derivatives - Ether - Carboxylic acid derivative - Oxacycle - Dialkyl ether - Organoheterocyclic compound - Carbonyl group - Organic oxygen compound - Organosulfur compound - Organooxygen compound - Organic oxide - Hydrocarbon derivative - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as indanes. These are compounds containing an indane moiety, which consists of a cyclopentane fused to a benzene ring.
External Descriptors
Not available