N-[(4-ethoxy-3-methoxy-phenyl)methyl]-1-(4-methylpiperidin-1-yl)sulfonyl-piperidine-3-carboxamide

Systemtic Name: N-[(4-ethoxy-3-methoxy-phenyl)methyl]-1-(4-methylpiperidin-1-yl)sulfonyl-piperidine-3-carboxamide Openeye Name: N-[(4-ethoxy-3-methoxy-phenyl)methyl]-1-[(4-methyl-1-piperidyl)sulfonyl]piperidine-3-carboxamide CAS Name: N-[(4-ethoxy-3-methoxyphenyl)methyl]-1-[(4-methyl-1-piperidinyl)sulfonyl]-3-piperidinecarboxamide IUPAC Name: N-[(4-ethoxy-3-methoxyphenyl)methyl]-1-(4-methylpiperidin-1-yl)sulfonylpiperidine-3-carboxamide Traditional Name: N-(4-ethoxy-3-methoxy-benzyl)-1-(4-methylpiperidino)sulfonyl-nipecotamide Formula: C22H35N3O5S MolecularWeight: 453.5954

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)CNC(=O)C2CCCN(C2)S(=O)(=O)N3CCC(CC3)C)OC

Isomeric SMILES

CCOC1=C(C=C(C=C1)CNC(=O)C2CCCN(C2)S(=O)(=O)N3CCC(CC3)C)OC

InChI

InChI=1S/C22H35N3O5S/c1-4-30-20-8-7-18(14-21(20)29-3)15-23-22(26)19-6-5-11-25(16-19)31(27,28)24-12-9-17(2)10-13-24/h7-8,14,17,19H,4-6,9-13,15-16H2,1-3H3,(H,23,26)