(phenylmethyl) 4-[3-(1-oxidanyl-2-piperidin-3-ylcarbonylimino-pyridin-3-yl)propyl]piperidine-1-carboxylate

Systemtic Name: (phenylmethyl) 4-[3-(1-oxidanyl-2-piperidin-3-ylcarbonylimino-pyridin-3-yl)propyl]piperidine-1-carboxylate Openeye Name: benzyl 4-[3-[1-hydroxy-2-(piperidine-3-carbonylimino)-3-pyridyl]propyl]piperidine-1-carboxylate CAS Name: 4-[3-[1-hydroxy-2-[oxo(3-piperidinyl)methyl]imino-3-pyridinyl]propyl]-1-piperidinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 4-[3-[1-hydroxy-2-(piperidine-3-carbonylimino)pyridin-3-yl]propyl]piperidine-1-carboxylate Traditional Name: 4-[3-(1-hydroxy-2-nipecotoylimino-3-pyridyl)propyl]piperidine-1-carboxylic acid benzyl ester Formula: C27H36N4O4 MolecularWeight: 480.59914

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CNC1)C(=O)N=C2C(=CC=CN2O)CCCC3CCN(CC3)C(=O)OCC4=CC=CC=C4

Isomeric SMILES

C1CC(CNC1)C(=O)N=C2C(=CC=CN2O)CCCC3CCN(CC3)C(=O)OCC4=CC=CC=C4

InChI

InChI=1S/C27H36N4O4/c32-26(24-11-5-15-28-19-24)29-25-23(12-6-16-31(25)34)10-4-9-21-13-17-30(18-14-21)27(33)35-20-22-7-2-1-3-8-22/h1-3,6-8,12,16,21,24,28,34H,4-5,9-11,13-15,17-20H2