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

Systemtic Name: (2R)-N-(2-azanylethyl)-1-ethanoyl-4-[(4-methoxyphenyl)methyl-phenethyl-amino]piperidine-2-carboxamide Openeye Name: (2R)-1-acetyl-N-(2-aminoethyl)-4-[(4-methoxyphenyl)methyl-phenethyl-amino]piperidine-2-carboxamide CAS Name: (2R)-1-acetyl-N-(2-aminoethyl)-4-[(4-methoxyphenyl)methyl-phenethylamino]-2-piperidinecarboxamide IUPAC Name: (2R)-1-acetyl-N-(2-aminoethyl)-4-[(4-methoxyphenyl)methyl-phenethylamino]piperidine-2-carboxamide Traditional Name: (2R)-1-acetyl-N-(2-aminoethyl)-4-[p-anisyl(phenethyl)amino]pipecolinamide Formula: C26H36N4O3 MolecularWeight: 452.58904

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCC(CC1C(=O)NCCN)N(CCC2=CC=CC=C2)CC3=CC=C(C=C3)OC

Isomeric SMILES

CC(=O)N1CCC(C[C@@H]1C(=O)NCCN)N(CCC2=CC=CC=C2)CC3=CC=C(C=C3)OC

InChI

InChI=1S/C26H36N4O3/c1-20(31)30-17-13-23(18-25(30)26(32)28-15-14-27)29(16-12-21-6-4-3-5-7-21)19-22-8-10-24(33-2)11-9-22/h3-11,23,25H,12-19,27H2,1-2H3,(H,28,32)/t23?,25-/m1/s1