(2R)-N-(4-azanylcyclohexyl)-1-ethanoyl-4-[(3-methoxyphenyl)methyl-(phenylmethyl)amino]piperidine-2-carboxamide

Systemtic Name: (2R)-N-(4-azanylcyclohexyl)-1-ethanoyl-4-[(3-methoxyphenyl)methyl-(phenylmethyl)amino]piperidine-2-carboxamide Openeye Name: (2R)-1-acetyl-N-(4-aminocyclohexyl)-4-[benzyl-[(3-methoxyphenyl)methyl]amino]piperidine-2-carboxamide CAS Name: (2R)-1-acetyl-N-(4-aminocyclohexyl)-4-[(3-methoxyphenyl)methyl-(phenylmethyl)amino]-2-piperidinecarboxamide IUPAC Name: (2R)-1-acetyl-N-(4-aminocyclohexyl)-4-[benzyl-[(3-methoxyphenyl)methyl]amino]piperidine-2-carboxamide Traditional Name: (2R)-1-acetyl-N-(4-aminocyclohexyl)-4-[benzyl(m-anisyl)amino]pipecolinamide Formula: C29H40N4O3 MolecularWeight: 492.6529

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCC(CC1C(=O)NC2CCC(CC2)N)N(CC3=CC=CC=C3)CC4=CC(=CC=C4)OC

Isomeric SMILES

CC(=O)N1CCC(C[C@@H]1C(=O)NC2CCC(CC2)N)N(CC3=CC=CC=C3)CC4=CC(=CC=C4)OC

InChI

InChI=1S/C29H40N4O3/c1-21(34)33-16-15-26(18-28(33)29(35)31-25-13-11-24(30)12-14-25)32(19-22-7-4-3-5-8-22)20-23-9-6-10-27(17-23)36-2/h3-10,17,24-26,28H,11-16,18-20,30H2,1-2H3,(H,31,35)/t24?,25?,26?,28-/m1/s1