Compound Identification
SMILES
CC1OC(=O)C2=CC=CC=C2S1=O
InChIKey
InChIKey=KZFOEOKKPGKCSE-UHFFFAOYSA-N
Formula
C9H8O3S
Mass
196.22
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
- Class Benzoxathiins
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Benzoxathiins
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Benzoxathiins
Alternative Parents
Oxathiins Benzenoids Monothioacetals Sulfoxides Lactones Carboxylic acid esters Sulfinyl compounds Oxacyclic compounds Monocarboxylic acids and derivatives Organooxygen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzenoid - 1,3-oxathiin - 1,3-benzooxathiin - Monothioacetal - Sulfoxide - Lactone - Carboxylic acid ester - Oxacycle - Sulfinyl compound - Monocarboxylic acid or derivatives - Carboxylic acid derivative - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as benzoxathiins. These are organic compounds containing a benzene fused to an oxathiin ring (a six-membered aliphatic ring with four carbon atoms, one oxygen atom, and one sulfur atom).
External Descriptors
Not available