(2R)-N-[[4-(aminomethyl)cyclohexyl]methyl]-1-ethanoyl-4-[(2-methylphenyl)methyl-phenethyl-amino]piperidine-2-carboxamide

Systemtic Name: (2R)-N-[[4-(aminomethyl)cyclohexyl]methyl]-1-ethanoyl-4-[(2-methylphenyl)methyl-phenethyl-amino]piperidine-2-carboxamide Openeye Name: (2R)-1-acetyl-N-[[4-(aminomethyl)cyclohexyl]methyl]-4-[o-tolylmethyl(phenethyl)amino]piperidine-2-carboxamide CAS Name: (2R)-1-acetyl-N-[[4-(aminomethyl)cyclohexyl]methyl]-4-[(2-methylphenyl)methyl-phenethylamino]-2-piperidinecarboxamide IUPAC Name: (2R)-1-acetyl-N-[[4-(aminomethyl)cyclohexyl]methyl]-4-[(2-methylphenyl)methyl-phenethylamino]piperidine-2-carboxamide Traditional Name: (2R)-1-acetyl-N-[[4-(aminomethyl)cyclohexyl]methyl]-4-[(2-methylbenzyl)-phenethyl-amino]pipecolinamide Formula: C32H46N4O2 MolecularWeight: 518.73324

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CN(CCC2=CC=CC=C2)C3CCN(C(C3)C(=O)NCC4CCC(CC4)CN)C(=O)C

Isomeric SMILES

CC1=CC=CC=C1CN(CCC2=CC=CC=C2)C3CCN([C@H](C3)C(=O)NCC4CCC(CC4)CN)C(=O)C

InChI

InChI=1S/C32H46N4O2/c1-24-8-6-7-11-29(24)23-35(18-16-26-9-4-3-5-10-26)30-17-19-36(25(2)37)31(20-30)32(38)34-22-28-14-12-27(21-33)13-15-28/h3-11,27-28,30-31H,12-23,33H2,1-2H3,(H,34,38)/t27?,28?,30?,31-/m1/s1