[3-[[4-(2-methoxyphenyl)piperazin-1-yl]methyl]-5-phenyl-pyridin-2-yl] methanesulfonate

Systemtic Name: [3-[[4-(2-methoxyphenyl)piperazin-1-yl]methyl]-5-phenyl-pyridin-2-yl] methanesulfonate Openeye Name: [3-[[4-(2-methoxyphenyl)piperazin-1-yl]methyl]-5-phenyl-2-pyridyl] methanesulfonate CAS Name: methanesulfonic acid [3-[[4-(2-methoxyphenyl)-1-piperazinyl]methyl]-5-phenyl-2-pyridinyl] ester IUPAC Name: [3-[[4-(2-methoxyphenyl)piperazin-1-yl]methyl]-5-phenylpyridin-2-yl] methanesulfonate Traditional Name: methanesulfonic acid [3-[[4-(2-methoxyphenyl)piperazino]methyl]-5-phenyl-2-pyridyl] ester Formula: C24H27N3O4S MolecularWeight: 453.55388

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N2CCN(CC2)CC3=C(N=CC(=C3)C4=CC=CC=C4)OS(=O)(=O)C

Isomeric SMILES

COC1=CC=CC=C1N2CCN(CC2)CC3=C(N=CC(=C3)C4=CC=CC=C4)OS(=O)(=O)C

InChI

InChI=1S/C24H27N3O4S/c1-30-23-11-7-6-10-22(23)27-14-12-26(13-15-27)18-21-16-20(19-8-4-3-5-9-19)17-25-24(21)31-32(2,28)29/h3-11,16-17H,12-15,18H2,1-2H3