ethyl 1-[1-cyclohexylimino-1-(4-ethoxycarbonylpiperidin-1-yl)-3-methyl-butan-2-yl]piperidine-4-carboxylate

Systemtic Name: ethyl 1-[1-cyclohexylimino-1-(4-ethoxycarbonylpiperidin-1-yl)-3-methyl-butan-2-yl]piperidine-4-carboxylate Openeye Name: ethyl 1-[1-[N-cyclohexyl-C-(4-ethoxycarbonyl-1-piperidyl)carbonimidoyl]-2-methyl-propyl]piperidine-4-carboxylate CAS Name: 1-[1-cyclohexylimino-1-(4-ethoxycarbonyl-1-piperidinyl)-3-methylbutan-2-yl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[1-cyclohexylimino-1-(4-ethoxycarbonylpiperidin-1-yl)-3-methylbutan-2-yl]piperidine-4-carboxylate Traditional Name: 1-[1-[C-(4-carbethoxypiperidino)-N-cyclohexyl-carbonimidoyl]-2-methyl-propyl]isonipecotic acid ethyl ester Formula: C27H47N3O4 MolecularWeight: 477.67978

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C(C(C)C)C(=NC2CCCCC2)N3CCC(CC3)C(=O)OCC

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C(C(C)C)C(=NC2CCCCC2)N3CCC(CC3)C(=O)OCC

InChI

InChI=1S/C27H47N3O4/c1-5-33-26(31)21-12-16-29(17-13-21)24(20(3)4)25(28-23-10-8-7-9-11-23)30-18-14-22(15-19-30)27(32)34-6-2/h20-24H,5-19H2,1-4H3