Compound Identification
SMILES
CC(C)(C)OC(=O)CCC1CC2=C(O1)C=CC(OS(=O)(=O)C(F)(F)F)=C2
InChIKey
InChIKey=DJDRGLSMBLTCCO-UHFFFAOYSA-N
Formula
C16H19F3O6S
Mass
396.38
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
- Class Coumarans
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Coumarans
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Coumarans
Alternative Parents
Trifluoromethanesulfonates Alkyl aryl ethers Fatty acid esters Sulfonic acid esters Organosulfonic acid esters Benzenoids Sulfonyls Methanesulfonates Trihalomethanes Carboxylic acid esters Oxacyclic compounds Monocarboxylic acids and derivatives Organic oxides Carbonyl compounds Organofluorides Alkyl fluorides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Coumaran - Trifluoromethanesulfonate - Alkyl aryl ether - Fatty acid ester - Fatty acyl - Benzenoid - Organosulfonic acid ester - Sulfonic acid ester - Methanesulfonate - Organic sulfonic acid or derivatives - Sulfonyl - Organosulfonic acid or derivatives - Carboxylic acid ester - Trihalomethane - Carboxylic acid derivative - Ether - Monocarboxylic acid or derivatives - Oxacycle - Organohalogen compound - Alkyl halide - Hydrocarbon derivative - Halomethane - Alkyl fluoride - Organic oxide - Organic oxygen compound - Carbonyl group - Organofluoride - Organooxygen compound - Organosulfur compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as coumarans. These are compounds containing the coumaran skeleton, which consists of a benzene ring fused to a 2,3-dihydrofuran ring.
External Descriptors
Not available