[2-oxidanylidene-2-(phenethylamino)ethyl] 4-[bis(fluoranyl)methylsulfanyl]benzoate

Systemtic Name: [2-oxidanylidene-2-(phenethylamino)ethyl] 4-[bis(fluoranyl)methylsulfanyl]benzoate Openeye Name: [2-oxo-2-(phenethylamino)ethyl] 4-(difluoromethylsulfanyl)benzoate CAS Name: 4-(difluoromethylthio)benzoic acid [2-oxo-2-(phenethylamino)ethyl] ester IUPAC Name: [2-oxo-2-(phenethylamino)ethyl] 4-(difluoromethylsulfanyl)benzoate Traditional Name: 4-(difluoromethylthio)benzoic acid [2-keto-2-(phenethylamino)ethyl] ester Formula: C18H17F2NO3S MolecularWeight: 365.394286

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCNC(=O)COC(=O)C2=CC=C(C=C2)SC(F)F

Isomeric SMILES

C1=CC=C(C=C1)CCNC(=O)COC(=O)C2=CC=C(C=C2)SC(F)F

InChI

InChI=1S/C18H17F2NO3S/c19-18(20)25-15-8-6-14(7-9-15)17(23)24-12-16(22)21-11-10-13-4-2-1-3-5-13/h1-9,18H,10-12H2,(H,21,22)