3-[[4-[[2-(cyclohexylmethoxy)phenoxy]methyl]piperidin-1-yl]methyl]-1H-pyridin-2-one; ethanedioic acid

Systemtic Name: 3-[[4-[[2-(cyclohexylmethoxy)phenoxy]methyl]piperidin-1-yl]methyl]-1H-pyridin-2-one; ethanedioic acid Openeye Name: 3-[[4-[[2-(cyclohexylmethoxy)phenoxy]methyl]-1-piperidyl]methyl]-1H-pyridin-2-one; oxalic acid CAS Name: 3-[[4-[[2-(cyclohexylmethoxy)phenoxy]methyl]-1-piperidinyl]methyl]-1H-pyridin-2-one; oxalic acid IUPAC Name: 3-[[4-[[2-(cyclohexylmethoxy)phenoxy]methyl]piperidin-1-yl]methyl]-1H-pyridin-2-one; oxalic acid Traditional Name: 3-[[4-[[2-(cyclohexylmethoxy)phenoxy]methyl]piperidino]methyl]-2-pyridone; oxalic acid Formula: C27H36N2O7 MolecularWeight: 500.58394

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)COC2=CC=CC=C2OCC3CCN(CC3)CC4=CC=CNC4=O.C(=O)(C(=O)O)O

Isomeric SMILES

C1CCC(CC1)COC2=CC=CC=C2OCC3CCN(CC3)CC4=CC=CNC4=O.C(=O)(C(=O)O)O

InChI

InChI=1S/C25H34N2O3.C2H2O4/c28-25-22(9-6-14-26-25)17-27-15-12-21(13-16-27)19-30-24-11-5-4-10-23(24)29-18-20-7-2-1-3-8-20;3-1(4)2(5)6/h4-6,9-11,14,20-21H,1-3,7-8,12-13,15-19H2,(H,26,28);(H,3,4)(H,5,6)