1-(2-cyanophenyl)sulfonyl-N-[[4-(ethoxymethyl)phenyl]methyl]piperidine-4-carboxamide

Systemtic Name: 1-(2-cyanophenyl)sulfonyl-N-[[4-(ethoxymethyl)phenyl]methyl]piperidine-4-carboxamide Openeye Name: 1-(2-cyanophenyl)sulfonyl-N-[[4-(ethoxymethyl)phenyl]methyl]piperidine-4-carboxamide CAS Name: 1-(2-cyanophenyl)sulfonyl-N-[[4-(ethoxymethyl)phenyl]methyl]-4-piperidinecarboxamide IUPAC Name: 1-(2-cyanophenyl)sulfonyl-N-[[4-(ethoxymethyl)phenyl]methyl]piperidine-4-carboxamide Traditional Name: 1-(2-cyanophenyl)sulfonyl-N-[4-(ethoxymethyl)benzyl]isonipecotamide Formula: C23H27N3O4S MolecularWeight: 441.54318

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOCC1=CC=C(C=C1)CNC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=CC=C3C#N

Isomeric SMILES

CCOCC1=CC=C(C=C1)CNC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=CC=C3C#N

InChI

InChI=1S/C23H27N3O4S/c1-2-30-17-19-9-7-18(8-10-19)16-25-23(27)20-11-13-26(14-12-20)31(28,29)22-6-4-3-5-21(22)15-24/h3-10,20H,2,11-14,16-17H2,1H3,(H,25,27)