(2R)-N-(2-azanylethyl)-1-(3-methoxyphenyl)carbonyl-4-[(4-methoxyphenyl)methyl-phenethyl-amino]piperidine-2-carboxamide

Systemtic Name: (2R)-N-(2-azanylethyl)-1-(3-methoxyphenyl)carbonyl-4-[(4-methoxyphenyl)methyl-phenethyl-amino]piperidine-2-carboxamide Openeye Name: (2R)-N-(2-aminoethyl)-1-(3-methoxybenzoyl)-4-[(4-methoxyphenyl)methyl-phenethyl-amino]piperidine-2-carboxamide CAS Name: (2R)-N-(2-aminoethyl)-4-[(4-methoxyphenyl)methyl-phenethylamino]-1-[(3-methoxyphenyl)-oxomethyl]-2-piperidinecarboxamide IUPAC Name: (2R)-N-(2-aminoethyl)-1-(3-methoxybenzoyl)-4-[(4-methoxyphenyl)methyl-phenethylamino]piperidine-2-carboxamide Traditional Name: (2R)-N-(2-aminoethyl)-1-m-anisoyl-4-[p-anisyl(phenethyl)amino]pipecolinamide Formula: C32H40N4O4 MolecularWeight: 544.6844

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CN(CCC2=CC=CC=C2)C3CCN(C(C3)C(=O)NCCN)C(=O)C4=CC(=CC=C4)OC

Isomeric SMILES

COC1=CC=C(C=C1)CN(CCC2=CC=CC=C2)C3CCN([C@H](C3)C(=O)NCCN)C(=O)C4=CC(=CC=C4)OC

InChI

InChI=1S/C32H40N4O4/c1-39-28-13-11-25(12-14-28)23-35(19-15-24-7-4-3-5-8-24)27-16-20-36(30(22-27)31(37)34-18-17-33)32(38)26-9-6-10-29(21-26)40-2/h3-14,21,27,30H,15-20,22-23,33H2,1-2H3,(H,34,37)/t27?,30-/m1/s1