[2-(2-methoxyphenyl)-6-[[4-(2-methoxyphenyl)piperazin-1-yl]methyl]pyridin-3-yl] methanesulfonate

Systemtic Name: [2-(2-methoxyphenyl)-6-[[4-(2-methoxyphenyl)piperazin-1-yl]methyl]pyridin-3-yl] methanesulfonate Openeye Name: [2-(2-methoxyphenyl)-6-[[4-(2-methoxyphenyl)piperazin-1-yl]methyl]-3-pyridyl] methanesulfonate CAS Name: methanesulfonic acid [2-(2-methoxyphenyl)-6-[[4-(2-methoxyphenyl)-1-piperazinyl]methyl]-3-pyridinyl] ester IUPAC Name: [2-(2-methoxyphenyl)-6-[[4-(2-methoxyphenyl)piperazin-1-yl]methyl]pyridin-3-yl] methanesulfonate Traditional Name: methanesulfonic acid [2-(2-methoxyphenyl)-6-[[4-(2-methoxyphenyl)piperazino]methyl]-3-pyridyl] ester Formula: C25H29N3O5S MolecularWeight: 483.57986

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C2=C(C=CC(=N2)CN3CCN(CC3)C4=CC=CC=C4OC)OS(=O)(=O)C

Isomeric SMILES

COC1=CC=CC=C1C2=C(C=CC(=N2)CN3CCN(CC3)C4=CC=CC=C4OC)OS(=O)(=O)C

InChI

InChI=1S/C25H29N3O5S/c1-31-22-10-6-4-8-20(22)25-24(33-34(3,29)30)13-12-19(26-25)18-27-14-16-28(17-15-27)21-9-5-7-11-23(21)32-2/h4-13H,14-18H2,1-3H3