Compound Identification
SMILES
CSC1=CC=CC=C1CNS(=O)(=O)C1=CC2=C(OC(=O)C=C2C(F)(F)F)C=C1
InChIKey
InChIKey=UDWBSUKSBPBHNQ-UHFFFAOYSA-N
Formula
C18H14F3NO4S2
Mass
429.43
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
- Superclass Phenylpropanoids and polyketides
Kingdom
Organic compounds
Superclass
Phenylpropanoids and polyketides
Class
Coumarins and derivatives
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Coumarins and derivatives
Alternative Parents
1-benzopyrans Thiophenol ethers Pyranones and derivatives Alkylarylthioethers Benzene and substituted derivatives Organosulfonamides Heteroaromatic compounds Aminosulfonyl compounds Lactones Sulfenyl compounds Oxacyclic compounds Organonitrogen compounds Organofluorides Organic oxides Hydrocarbon derivatives Organooxygen compounds Alkyl fluorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Coumarin - Benzopyran - 1-benzopyran - Aryl thioether - Thiophenol ether - Pyranone - Alkylarylthioether - Monocyclic benzene moiety - Pyran - Organosulfonic acid amide - Benzenoid - Aminosulfonyl compound - Sulfonyl - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Heteroaromatic compound - Lactone - Sulfenyl compound - Organoheterocyclic compound - Thioether - Oxacycle - Hydrocarbon derivative - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organofluoride - Organohalogen compound - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Alkyl halide - Alkyl fluoride - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as coumarins and derivatives. These are polycyclic aromatic compounds containing a 1-benzopyran moiety with a ketone group at the C2 carbon atom (1-benzopyran-2-one).
External Descriptors
Not available