Compound Identification
SMILES
COC(=O)[C@H]1CC[C@@H](C1)SC1=C(Cl)C(Cl)=C2C(CC(C)(C3CCCC3)C2=O)=C1
InChIKey
InChIKey=RRJOOEIMMRMECZ-OOIFWABNSA-N
Formula
C22H26Cl2O3S
Mass
441.41
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
- Superclass Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Indanes
Subclass
Indanones
Intermediate Tree Nodes
Not available
Direct Parent
Indanones
Alternative Parents
Thiophenol ethers Aryl alkyl ketones Alkylarylthioethers Aryl chlorides Vinylogous halides Methyl esters Sulfenyl compounds Monocarboxylic acids and derivatives Organochlorides Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic homopolycyclic compounds
Substituents
Indanone - Aryl thioether - Thiophenol ether - Aryl ketone - Aryl alkyl ketone - Alkylarylthioether - Aryl halide - Aryl chloride - Vinylogous halide - Methyl ester - Carboxylic acid ester - Ketone - Carboxylic acid derivative - Sulfenyl compound - Thioether - Monocarboxylic acid or derivatives - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organohalogen compound - Organochloride - Organooxygen compound - Organosulfur compound - Aromatic homopolycyclic compound
Description
This compound belongs to the class of organic compounds known as indanones. These are compounds containing an indane ring bearing a ketone group.
External Descriptors
Not available