N-[2-[bis(fluoranyl)methylsulfanyl]phenyl]-1-(2-nitrophenyl)piperidine-4-carboxamide

Systemtic Name: N-[2-[bis(fluoranyl)methylsulfanyl]phenyl]-1-(2-nitrophenyl)piperidine-4-carboxamide Openeye Name: N-[2-(difluoromethylsulfanyl)phenyl]-1-(2-nitrophenyl)piperidine-4-carboxamide CAS Name: N-[2-(difluoromethylthio)phenyl]-1-(2-nitrophenyl)-4-piperidinecarboxamide IUPAC Name: N-[2-(difluoromethylsulfanyl)phenyl]-1-(2-nitrophenyl)piperidine-4-carboxamide Traditional Name: N-[2-(difluoromethylthio)phenyl]-1-(2-nitrophenyl)isonipecotamide Formula: C19H19F2N3O3S MolecularWeight: 407.434266

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NC2=CC=CC=C2SC(F)F)C3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

C1CN(CCC1C(=O)NC2=CC=CC=C2SC(F)F)C3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C19H19F2N3O3S/c20-19(21)28-17-8-4-1-5-14(17)22-18(25)13-9-11-23(12-10-13)15-6-2-3-7-16(15)24(26)27/h1-8,13,19H,9-12H2,(H,22,25)