7-[4-[bis(fluoranyl)methylsulfanyl]phenyl]-5-oxidanyl-1,3-benzoxathiol-2-one

Systemtic Name: 7-[4-[bis(fluoranyl)methylsulfanyl]phenyl]-5-oxidanyl-1,3-benzoxathiol-2-one Openeye Name: 7-[4-(difluoromethylsulfanyl)phenyl]-5-hydroxy-1,3-benzoxathiol-2-one CAS Name: 7-[4-(difluoromethylthio)phenyl]-5-hydroxy-1,3-benzoxathiol-2-one IUPAC Name: 7-[4-(difluoromethylsulfanyl)phenyl]-5-hydroxy-1,3-benzoxathiol-2-one Traditional Name: 7-[4-(difluoromethylthio)phenyl]-5-hydroxy-1,3-benzoxathiol-2-one Formula: C14H8F2O3S2 MolecularWeight: 326.338326

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=CC(=CC3=C2OC(=O)S3)O)SC(F)F

Isomeric SMILES

C1=CC(=CC=C1C2=CC(=CC3=C2OC(=O)S3)O)SC(F)F

InChI

InChI=1S/C14H8F2O3S2/c15-13(16)20-9-3-1-7(2-4-9)10-5-8(17)6-11-12(10)19-14(18)21-11/h1-6,13,17H