N-[[1-(dimethylamino)cycloheptyl]methyl]-1-(4-fluorophenyl)sulfonyl-piperidine-4-carboxamide

Systemtic Name: N-[[1-(dimethylamino)cycloheptyl]methyl]-1-(4-fluorophenyl)sulfonyl-piperidine-4-carboxamide Openeye Name: N-[[1-(dimethylamino)cycloheptyl]methyl]-1-(4-fluorophenyl)sulfonyl-piperidine-4-carboxamide CAS Name: N-[[1-(dimethylamino)cycloheptyl]methyl]-1-(4-fluorophenyl)sulfonyl-4-piperidinecarboxamide IUPAC Name: N-[[1-(dimethylamino)cycloheptyl]methyl]-1-(4-fluorophenyl)sulfonylpiperidine-4-carboxamide Traditional Name: N-[[1-(dimethylamino)cycloheptyl]methyl]-1-(4-fluorophenyl)sulfonyl-isonipecotamide Formula: C22H34FN3O3S MolecularWeight: 439.587063

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1(CCCCCC1)CNC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)F

Isomeric SMILES

CN(C)C1(CCCCCC1)CNC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C22H34FN3O3S/c1-25(2)22(13-5-3-4-6-14-22)17-24-21(27)18-11-15-26(16-12-18)30(28,29)20-9-7-19(23)8-10-20/h7-10,18H,3-6,11-17H2,1-2H3,(H,24,27)