(2R)-N-[2-[bis(fluoranyl)methylsulfanyl]phenyl]pyrrolidin-1-ium-2-carboxamide

Systemtic Name: (2R)-N-[2-[bis(fluoranyl)methylsulfanyl]phenyl]pyrrolidin-1-ium-2-carboxamide Openeye Name: (2R)-N-[2-(difluoromethylsulfanyl)phenyl]pyrrolidin-1-ium-2-carboxamide CAS Name: (2R)-N-[2-(difluoromethylthio)phenyl]-2-pyrrolidin-1-iumcarboxamide IUPAC Name: (2R)-N-[2-(difluoromethylsulfanyl)phenyl]pyrrolidin-1-ium-2-carboxamide Traditional Name: (2R)-N-[2-(difluoromethylthio)phenyl]pyrrolidin-1-ium-2-carboxamide Formula: C12H15F2N2OS+ MolecularWeight: 273.322106

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Descriptors Computed from Structure

Canonical SMILES:

C1CC([NH2+]C1)C(=O)NC2=CC=CC=C2SC(F)F

Isomeric SMILES

C1C[C@@H]([NH2+]C1)C(=O)NC2=CC=CC=C2SC(F)F

InChI

InChI=1S/C12H14F2N2OS/c13-12(14)18-10-6-2-1-4-8(10)16-11(17)9-5-3-7-15-9/h1-2,4,6,9,12,15H,3,5,7H2,(H,16,17)/p+1/t9-/m1/s1