(2R)-N-(4-azanylcyclohexyl)-1-(2-methoxyethanoyl)-4-[(4-methylphenyl)methyl-phenethyl-amino]piperidine-2-carboxamide

Systemtic Name: (2R)-N-(4-azanylcyclohexyl)-1-(2-methoxyethanoyl)-4-[(4-methylphenyl)methyl-phenethyl-amino]piperidine-2-carboxamide Openeye Name: (2R)-N-(4-aminocyclohexyl)-1-(2-methoxyacetyl)-4-[phenethyl(p-tolylmethyl)amino]piperidine-2-carboxamide CAS Name: (2R)-N-(4-aminocyclohexyl)-1-(2-methoxy-1-oxoethyl)-4-[(4-methylphenyl)methyl-phenethylamino]-2-piperidinecarboxamide IUPAC Name: (2R)-N-(4-aminocyclohexyl)-1-(2-methoxyacetyl)-4-[(4-methylphenyl)methyl-phenethylamino]piperidine-2-carboxamide Traditional Name: (2R)-N-(4-aminocyclohexyl)-1-(2-methoxyacetyl)-4-[(4-methylbenzyl)-phenethyl-amino]pipecolinamide Formula: C31H44N4O3 MolecularWeight: 520.70606

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN(CCC2=CC=CC=C2)C3CCN(C(C3)C(=O)NC4CCC(CC4)N)C(=O)COC

Isomeric SMILES

CC1=CC=C(C=C1)CN(CCC2=CC=CC=C2)C3CCN([C@H](C3)C(=O)NC4CCC(CC4)N)C(=O)COC

InChI

InChI=1S/C31H44N4O3/c1-23-8-10-25(11-9-23)21-34(18-16-24-6-4-3-5-7-24)28-17-19-35(30(36)22-38-2)29(20-28)31(37)33-27-14-12-26(32)13-15-27/h3-11,26-29H,12-22,32H2,1-2H3,(H,33,37)/t26?,27?,28?,29-/m1/s1