3-(2-methoxyphenyl)-1-[4-[3-[(4-pyridin-2-ylpiperazin-1-yl)methyl]phenoxy]piperidin-1-yl]propan-1-one

Systemtic Name: 3-(2-methoxyphenyl)-1-[4-[3-[(4-pyridin-2-ylpiperazin-1-yl)methyl]phenoxy]piperidin-1-yl]propan-1-one Openeye Name: 3-(2-methoxyphenyl)-1-[4-[3-[[4-(2-pyridyl)piperazin-1-yl]methyl]phenoxy]-1-piperidyl]propan-1-one CAS Name: 3-(2-methoxyphenyl)-1-[4-[3-[[4-(2-pyridinyl)-1-piperazinyl]methyl]phenoxy]-1-piperidinyl]-1-propanone IUPAC Name: 3-(2-methoxyphenyl)-1-[4-[3-[(4-pyridin-2-ylpiperazin-1-yl)methyl]phenoxy]piperidin-1-yl]propan-1-one Traditional Name: 3-(2-methoxyphenyl)-1-[4-[3-[[4-(2-pyridyl)piperazino]methyl]phenoxy]piperidino]propan-1-one Formula: C31H38N4O3 MolecularWeight: 514.65842

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1CCC(=O)N2CCC(CC2)OC3=CC=CC(=C3)CN4CCN(CC4)C5=CC=CC=N5

Isomeric SMILES

COC1=CC=CC=C1CCC(=O)N2CCC(CC2)OC3=CC=CC(=C3)CN4CCN(CC4)C5=CC=CC=N5

InChI

InChI=1S/C31H38N4O3/c1-37-29-10-3-2-8-26(29)12-13-31(36)35-17-14-27(15-18-35)38-28-9-6-7-25(23-28)24-33-19-21-34(22-20-33)30-11-4-5-16-32-30/h2-11,16,23,27H,12-15,17-22,24H2,1H3