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

Systemtic Name: 1-[4-[1-[methyl(pyridin-4-ylmethyl)amino]-2-phenyl-ethyl]piperidin-1-yl]-3-phenyl-prop-2-yn-1-one Openeye Name: 1-[4-[1-[methyl(4-pyridylmethyl)amino]-2-phenyl-ethyl]-1-piperidyl]-3-phenyl-prop-2-yn-1-one CAS Name: 1-[4-[1-[methyl(pyridin-4-ylmethyl)amino]-2-phenylethyl]-1-piperidinyl]-3-phenyl-2-propyn-1-one IUPAC Name: 1-[4-[1-[methyl(pyridin-4-ylmethyl)amino]-2-phenylethyl]piperidin-1-yl]-3-phenylprop-2-yn-1-one Traditional Name: 1-[4-[1-[methyl(4-pyridylmethyl)amino]-2-phenyl-ethyl]piperidino]-3-phenyl-prop-2-yn-1-one Formula: C29H31N3O MolecularWeight: 437.57594

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=NC=C1)C(CC2=CC=CC=C2)C3CCN(CC3)C(=O)C#CC4=CC=CC=C4

Isomeric SMILES

CN(CC1=CC=NC=C1)C(CC2=CC=CC=C2)C3CCN(CC3)C(=O)C#CC4=CC=CC=C4

InChI

InChI=1S/C29H31N3O/c1-31(23-26-14-18-30-19-15-26)28(22-25-10-6-3-7-11-25)27-16-20-32(21-17-27)29(33)13-12-24-8-4-2-5-9-24/h2-11,14-15,18-19,27-28H,16-17,20-23H2,1H3