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

Systemtic Name: (2R)-N-(4-azanylcyclohexyl)-1-ethanoyl-4-[oxolan-2-ylmethyl-(phenylmethyl)amino]piperidine-2-carboxamide Openeye Name: (2R)-1-acetyl-N-(4-aminocyclohexyl)-4-[benzyl(tetrahydrofuran-2-ylmethyl)amino]piperidine-2-carboxamide CAS Name: (2R)-1-acetyl-N-(4-aminocyclohexyl)-4-[2-oxolanylmethyl-(phenylmethyl)amino]-2-piperidinecarboxamide IUPAC Name: (2R)-1-acetyl-N-(4-aminocyclohexyl)-4-[benzyl(oxolan-2-ylmethyl)amino]piperidine-2-carboxamide Traditional Name: (2R)-1-acetyl-N-(4-aminocyclohexyl)-4-[benzyl(tetrahydrofurfuryl)amino]pipecolinamide Formula: C26H40N4O3 MolecularWeight: 456.6208

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H40N4O3/c1-19(31)30-14-13-23(16-25(30)26(32)28-22-11-9-21(27)10-12-22)29(18-24-8-5-15-33-24)17-20-6-3-2-4-7-20/h2-4,6-7,21-25H,5,8-18,27H2,1H3,(H,28,32)/t21?,22?,23?,24?,25-/m1/s1