1-[4-[1-[methyl(pyridin-4-ylmethyl)amino]-2-phenyl-ethyl]piperidin-1-yl]-3-phenoxy-propan-1-one

Systemtic Name: 1-[4-[1-[methyl(pyridin-4-ylmethyl)amino]-2-phenyl-ethyl]piperidin-1-yl]-3-phenoxy-propan-1-one Openeye Name: 1-[4-[1-[methyl(4-pyridylmethyl)amino]-2-phenyl-ethyl]-1-piperidyl]-3-phenoxy-propan-1-one CAS Name: 1-[4-[1-[methyl(pyridin-4-ylmethyl)amino]-2-phenylethyl]-1-piperidinyl]-3-phenoxy-1-propanone IUPAC Name: 1-[4-[1-[methyl(pyridin-4-ylmethyl)amino]-2-phenylethyl]piperidin-1-yl]-3-phenoxypropan-1-one Traditional Name: 1-[4-[1-[methyl(4-pyridylmethyl)amino]-2-phenyl-ethyl]piperidino]-3-phenoxy-propan-1-one Formula: C29H35N3O2 MolecularWeight: 457.6071

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=NC=C1)C(CC2=CC=CC=C2)C3CCN(CC3)C(=O)CCOC4=CC=CC=C4

Isomeric SMILES

CN(CC1=CC=NC=C1)C(CC2=CC=CC=C2)C3CCN(CC3)C(=O)CCOC4=CC=CC=C4

InChI

InChI=1S/C29H35N3O2/c1-31(23-25-12-17-30-18-13-25)28(22-24-8-4-2-5-9-24)26-14-19-32(20-15-26)29(33)16-21-34-27-10-6-3-7-11-27/h2-13,17-18,26,28H,14-16,19-23H2,1H3