[1-[[4-(3-piperidin-1-ylpropoxy)phenyl]methyl]piperidin-4-yl] methanesulfonate

Systemtic Name: [1-[[4-(3-piperidin-1-ylpropoxy)phenyl]methyl]piperidin-4-yl] methanesulfonate Openeye Name: [1-[[4-[3-(1-piperidyl)propoxy]phenyl]methyl]-4-piperidyl] methanesulfonate CAS Name: methanesulfonic acid [1-[[4-[3-(1-piperidinyl)propoxy]phenyl]methyl]-4-piperidinyl] ester IUPAC Name: [1-[[4-(3-piperidin-1-ylpropoxy)phenyl]methyl]piperidin-4-yl] methanesulfonate Traditional Name: methanesulfonic acid [1-[4-(3-piperidinopropoxy)benzyl]-4-piperidyl] ester Formula: C21H34N2O4S MolecularWeight: 410.57066

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)OC1CCN(CC1)CC2=CC=C(C=C2)OCCCN3CCCCC3

Isomeric SMILES

CS(=O)(=O)OC1CCN(CC1)CC2=CC=C(C=C2)OCCCN3CCCCC3

InChI

InChI=1S/C21H34N2O4S/c1-28(24,25)27-21-10-15-23(16-11-21)18-19-6-8-20(9-7-19)26-17-5-14-22-12-3-2-4-13-22/h6-9,21H,2-5,10-18H2,1H3