N-[2-(dimethylamino)-2-oxidanylidene-ethyl]-1-[3-(trifluoromethyloxy)phenyl]sulfonyl-piperidine-4-carboxamide

Systemtic Name: N-[2-(dimethylamino)-2-oxidanylidene-ethyl]-1-[3-(trifluoromethyloxy)phenyl]sulfonyl-piperidine-4-carboxamide Openeye Name: N-[2-(dimethylamino)-2-oxo-ethyl]-1-[3-(trifluoromethoxy)phenyl]sulfonyl-piperidine-4-carboxamide CAS Name: N-[2-(dimethylamino)-2-oxoethyl]-1-[3-(trifluoromethoxy)phenyl]sulfonyl-4-piperidinecarboxamide IUPAC Name: N-[2-(dimethylamino)-2-oxoethyl]-1-[3-(trifluoromethoxy)phenyl]sulfonylpiperidine-4-carboxamide Traditional Name: N-[2-(dimethylamino)-2-keto-ethyl]-1-[3-(trifluoromethoxy)phenyl]sulfonyl-isonipecotamide Formula: C17H22F3N3O5S MolecularWeight: 437.43389

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)CNC(=O)C1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)OC(F)(F)F

Isomeric SMILES

CN(C)C(=O)CNC(=O)C1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)OC(F)(F)F

InChI

InChI=1S/C17H22F3N3O5S/c1-22(2)15(24)11-21-16(25)12-6-8-23(9-7-12)29(26,27)14-5-3-4-13(10-14)28-17(18,19)20/h3-5,10,12H,6-9,11H2,1-2H3,(H,21,25)