Compound Identification
SMILES
COC(=O)[C@@H]1SCC2=CC=CC=C2C1=O
InChIKey
InChIKey=ZABHGNJADRQSKO-SNVBAGLBSA-N
Formula
C11H10O3S
Mass
222.26
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
- Class Isothiochromanes
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Isothiochromanes
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Isothiochromanes
Alternative Parents
2-benzothiopyrans Aryl alkyl ketones Benzenoids 1,3-dicarbonyl compounds Methyl esters Monocarboxylic acids and derivatives Dialkylthioethers Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Isothiochromane - 2-benzothiopyran - Benzothiopyran - Aryl alkyl ketone - Aryl ketone - 1,3-dicarbonyl compound - Benzenoid - Methyl ester - Carboxylic acid ester - Ketone - Thioether - Monocarboxylic acid or derivatives - Carboxylic acid derivative - Dialkylthioether - Organic oxide - Organooxygen compound - Carbonyl group - Organic oxygen compound - Hydrocarbon derivative - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as isothiochromanes. These are organic heterocyclic compounds containing an isothiochromane moiety.
External Descriptors
Not available