[1-[1-[4-(4-fluorophenyl)-4-oxidanylidene-butyl]piperidin-4-yl]-1-phenyl-ethyl] methanesulfonate

Systemtic Name: [1-[1-[4-(4-fluorophenyl)-4-oxidanylidene-butyl]piperidin-4-yl]-1-phenyl-ethyl] methanesulfonate Openeye Name: [1-[1-[4-(4-fluorophenyl)-4-oxo-butyl]-4-piperidyl]-1-phenyl-ethyl] methanesulfonate CAS Name: methanesulfonic acid [1-[1-[4-(4-fluorophenyl)-4-oxobutyl]-4-piperidinyl]-1-phenylethyl] ester IUPAC Name: [1-[1-[4-(4-fluorophenyl)-4-oxobutyl]piperidin-4-yl]-1-phenylethyl] methanesulfonate Traditional Name: methanesulfonic acid [1-[1-[4-(4-fluorophenyl)-4-keto-butyl]-4-piperidyl]-1-phenyl-ethyl] ester Formula: C24H30FNO4S MolecularWeight: 447.562703

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1CCN(CC1)CCCC(=O)C2=CC=C(C=C2)F)(C3=CC=CC=C3)OS(=O)(=O)C

Isomeric SMILES

CC(C1CCN(CC1)CCCC(=O)C2=CC=C(C=C2)F)(C3=CC=CC=C3)OS(=O)(=O)C

InChI

InChI=1S/C24H30FNO4S/c1-24(30-31(2,28)29,20-7-4-3-5-8-20)21-14-17-26(18-15-21)16-6-9-23(27)19-10-12-22(25)13-11-19/h3-5,7-8,10-13,21H,6,9,14-18H2,1-2H3