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

Systemtic Name: (2R)-N-(4-azanylcyclohexyl)-1-ethanoyl-4-[(4-methoxyphenyl)methyl-(oxolan-2-ylmethyl)amino]piperidine-2-carboxamide Openeye Name: (2R)-1-acetyl-N-(4-aminocyclohexyl)-4-[(4-methoxyphenyl)methyl-(tetrahydrofuran-2-ylmethyl)amino]piperidine-2-carboxamide CAS Name: (2R)-1-acetyl-N-(4-aminocyclohexyl)-4-[(4-methoxyphenyl)methyl-(2-oxolanylmethyl)amino]-2-piperidinecarboxamide IUPAC Name: (2R)-1-acetyl-N-(4-aminocyclohexyl)-4-[(4-methoxyphenyl)methyl-(oxolan-2-ylmethyl)amino]piperidine-2-carboxamide Traditional Name: (2R)-1-acetyl-N-(4-aminocyclohexyl)-4-[p-anisyl(tetrahydrofurfuryl)amino]pipecolinamide Formula: C27H42N4O4 MolecularWeight: 486.64678

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCC(CC1C(=O)NC2CCC(CC2)N)N(CC3CCCO3)CC4=CC=C(C=C4)OC

Isomeric SMILES

CC(=O)N1CCC(C[C@@H]1C(=O)NC2CCC(CC2)N)N(CC3CCCO3)CC4=CC=C(C=C4)OC

InChI

InChI=1S/C27H42N4O4/c1-19(32)31-14-13-23(16-26(31)27(33)29-22-9-7-21(28)8-10-22)30(18-25-4-3-15-35-25)17-20-5-11-24(34-2)12-6-20/h5-6,11-12,21-23,25-26H,3-4,7-10,13-18,28H2,1-2H3,(H,29,33)/t21?,22?,23?,25?,26-/m1/s1