[4-(4-methoxyphenyl)-1-methyl-piperidin-3-yl]methyl benzenesulfonate

Systemtic Name: [4-(4-methoxyphenyl)-1-methyl-piperidin-3-yl]methyl benzenesulfonate Openeye Name: [4-(4-methoxyphenyl)-1-methyl-3-piperidyl]methyl benzenesulfonate CAS Name: benzenesulfonic acid [4-(4-methoxyphenyl)-1-methyl-3-piperidinyl]methyl ester IUPAC Name: [4-(4-methoxyphenyl)-1-methylpiperidin-3-yl]methyl benzenesulfonate Traditional Name: benzenesulfonic acid [4-(4-methoxyphenyl)-1-methyl-3-piperidyl]methyl ester Formula: C20H25NO4S MolecularWeight: 375.4818

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1CCC(C(C1)COS(=O)(=O)C2=CC=CC=C2)C3=CC=C(C=C3)OC

Isomeric SMILES

CN1CCC(C(C1)COS(=O)(=O)C2=CC=CC=C2)C3=CC=C(C=C3)OC

InChI

InChI=1S/C20H25NO4S/c1-21-13-12-20(16-8-10-18(24-2)11-9-16)17(14-21)15-25-26(22,23)19-6-4-3-5-7-19/h3-11,17,20H,12-15H2,1-2H3