Compound Identification
SMILES
COC(=O)C(=C1OC2=C(C=C(C=C2S1)C(C)(C)C)C(C)(C)C)C(F)(F)F
InChIKey
InChIKey=JTBIHDONBHGXEY-UHFFFAOYSA-N
Formula
C19H23F3O3S
Mass
388.45
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
- Class Benzoxathioles
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Benzoxathioles
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Benzoxathioles
Alternative Parents
Aryl thioethers Vinylogous thioesters Benzenoids Vinylogous esters Monothioacetals Methyl esters Enoate esters Ketene acetals Oxacyclic compounds Monocarboxylic acids and derivatives Organofluorides Organic oxides Hydrocarbon derivatives Carbonyl compounds Alkyl fluorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzoxathiole - Aryl thioether - Vinylogous thioester - Benzenoid - Monothioacetal - Methyl ester - Enoate ester - Vinylogous ester - Alpha,beta-unsaturated carboxylic ester - Carboxylic acid ester - Ketene acetal or derivatives - Monocarboxylic acid or derivatives - Carboxylic acid derivative - Oxacycle - Organooxygen compound - Organofluoride - Organohalogen compound - Organic oxide - Alkyl halide - Alkyl fluoride - Carbonyl group - Organic oxygen compound - Hydrocarbon derivative - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as benzoxathioles. These are organic compounds containing a benzene fused to an oxathiole ring (a five-membered ring with four carbon atoms, one oxygen atom, and one sulfur atom).
External Descriptors
Not available