N-[[2-[(4-methylpiperidin-1-yl)methyl]phenyl]methyl]-1-[(E)-3-phenylprop-2-enoyl]piperidine-4-carboxamide

Systemtic Name: N-[[2-[(4-methylpiperidin-1-yl)methyl]phenyl]methyl]-1-[(E)-3-phenylprop-2-enoyl]piperidine-4-carboxamide Openeye Name: N-[[2-[(4-methyl-1-piperidyl)methyl]phenyl]methyl]-1-[(E)-3-phenylprop-2-enoyl]piperidine-4-carboxamide CAS Name: N-[[2-[(4-methyl-1-piperidinyl)methyl]phenyl]methyl]-1-[(E)-1-oxo-3-phenylprop-2-enyl]-4-piperidinecarboxamide IUPAC Name: N-[[2-[(4-methylpiperidin-1-yl)methyl]phenyl]methyl]-1-[(E)-3-phenylprop-2-enoyl]piperidine-4-carboxamide Traditional Name: N-[2-[(4-methylpiperidino)methyl]benzyl]-1-[(E)-3-phenylacryloyl]isonipecotamide Formula: C29H37N3O2 MolecularWeight: 459.62298

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)CC2=CC=CC=C2CNC(=O)C3CCN(CC3)C(=O)C=CC4=CC=CC=C4

Isomeric SMILES

CC1CCN(CC1)CC2=CC=CC=C2CNC(=O)C3CCN(CC3)C(=O)/C=C/C4=CC=CC=C4

InChI

InChI=1S/C29H37N3O2/c1-23-13-17-31(18-14-23)22-27-10-6-5-9-26(27)21-30-29(34)25-15-19-32(20-16-25)28(33)12-11-24-7-3-2-4-8-24/h2-12,23,25H,13-22H2,1H3,(H,30,34)/b12-11+