N-[3,5-bis(trifluoromethyl)phenyl]-1-(2-fluorophenyl)sulfonyl-piperidine-4-carboxamide

Systemtic Name: N-[3,5-bis(trifluoromethyl)phenyl]-1-(2-fluorophenyl)sulfonyl-piperidine-4-carboxamide Openeye Name: N-[3,5-bis(trifluoromethyl)phenyl]-1-(2-fluorophenyl)sulfonyl-piperidine-4-carboxamide CAS Name: N-[3,5-bis(trifluoromethyl)phenyl]-1-(2-fluorophenyl)sulfonyl-4-piperidinecarboxamide IUPAC Name: N-[3,5-bis(trifluoromethyl)phenyl]-1-(2-fluorophenyl)sulfonylpiperidine-4-carboxamide Traditional Name: N-[3,5-bis(trifluoromethyl)phenyl]-1-(2-fluorophenyl)sulfonyl-isonipecotamide Formula: C20H17F7N2O3S MolecularWeight: 498.414402

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NC2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F)S(=O)(=O)C3=CC=CC=C3F

Isomeric SMILES

C1CN(CCC1C(=O)NC2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F)S(=O)(=O)C3=CC=CC=C3F

InChI

InChI=1S/C20H17F7N2O3S/c21-16-3-1-2-4-17(16)33(31,32)29-7-5-12(6-8-29)18(30)28-15-10-13(19(22,23)24)9-14(11-15)20(25,26)27/h1-4,9-12H,5-8H2,(H,28,30)