(2R)-N-(2-azanylethyl)-4-[(3-methoxyphenyl)methyl-(phenylmethyl)amino]-1-pyridin-3-ylcarbonyl-piperidine-2-carboxamide

Systemtic Name: (2R)-N-(2-azanylethyl)-4-[(3-methoxyphenyl)methyl-(phenylmethyl)amino]-1-pyridin-3-ylcarbonyl-piperidine-2-carboxamide Openeye Name: (2R)-N-(2-aminoethyl)-4-[benzyl-[(3-methoxyphenyl)methyl]amino]-1-(pyridine-3-carbonyl)piperidine-2-carboxamide CAS Name: (2R)-N-(2-aminoethyl)-4-[(3-methoxyphenyl)methyl-(phenylmethyl)amino]-1-[oxo(3-pyridinyl)methyl]-2-piperidinecarboxamide IUPAC Name: (2R)-N-(2-aminoethyl)-4-[benzyl-[(3-methoxyphenyl)methyl]amino]-1-(pyridine-3-carbonyl)piperidine-2-carboxamide Traditional Name: (2R)-N-(2-aminoethyl)-4-[benzyl(m-anisyl)amino]-1-nicotinoyl-pipecolinamide Formula: C29H35N5O3 MolecularWeight: 501.6199

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)CN(CC2=CC=CC=C2)C3CCN(C(C3)C(=O)NCCN)C(=O)C4=CN=CC=C4

Isomeric SMILES

COC1=CC=CC(=C1)CN(CC2=CC=CC=C2)C3CCN([C@H](C3)C(=O)NCCN)C(=O)C4=CN=CC=C4

InChI

InChI=1S/C29H35N5O3/c1-37-26-11-5-9-23(17-26)21-33(20-22-7-3-2-4-8-22)25-12-16-34(27(18-25)28(35)32-15-13-30)29(36)24-10-6-14-31-19-24/h2-11,14,17,19,25,27H,12-13,15-16,18,20-21,30H2,1H3,(H,32,35)/t25?,27-/m1/s1