2-[1-[(3-methoxy-4-oxidanyl-phenyl)methyl]piperidin-4-yl]-6-methyl-N-[(2-methylphenyl)methyl]pyridine-3-carboxamide

Systemtic Name: 2-[1-[(3-methoxy-4-oxidanyl-phenyl)methyl]piperidin-4-yl]-6-methyl-N-[(2-methylphenyl)methyl]pyridine-3-carboxamide Openeye Name: 2-[1-[(4-hydroxy-3-methoxy-phenyl)methyl]-4-piperidyl]-6-methyl-N-(o-tolylmethyl)pyridine-3-carboxamide CAS Name: 2-[1-[(4-hydroxy-3-methoxyphenyl)methyl]-4-piperidinyl]-6-methyl-N-[(2-methylphenyl)methyl]-3-pyridinecarboxamide IUPAC Name: 2-[1-[(4-hydroxy-3-methoxyphenyl)methyl]piperidin-4-yl]-6-methyl-N-[(2-methylphenyl)methyl]pyridine-3-carboxamide Traditional Name: 6-methyl-N-(2-methylbenzyl)-2-(1-vanillyl-4-piperidyl)nicotinamide Formula: C28H33N3O3 MolecularWeight: 459.57992

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(C=C1)C(=O)NCC2=CC=CC=C2C)C3CCN(CC3)CC4=CC(=C(C=C4)O)OC

Isomeric SMILES

CC1=NC(=C(C=C1)C(=O)NCC2=CC=CC=C2C)C3CCN(CC3)CC4=CC(=C(C=C4)O)OC

InChI

InChI=1S/C28H33N3O3/c1-19-6-4-5-7-23(19)17-29-28(33)24-10-8-20(2)30-27(24)22-12-14-31(15-13-22)18-21-9-11-25(32)26(16-21)34-3/h4-11,16,22,32H,12-15,17-18H2,1-3H3,(H,29,33)