tert-butyl N-[1-phenyl-3-[(1-pyridin-4-ylpiperidin-4-yl)carbonylamino]propan-2-yl]carbamate

Systemtic Name: tert-butyl N-[1-phenyl-3-[(1-pyridin-4-ylpiperidin-4-yl)carbonylamino]propan-2-yl]carbamate Openeye Name: tert-butyl N-[1-benzyl-2-[[1-(4-pyridyl)piperidine-4-carbonyl]amino]ethyl]carbamate CAS Name: N-[1-[[oxo-(1-pyridin-4-yl-4-piperidinyl)methyl]amino]-3-phenylpropan-2-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[1-phenyl-3-[(1-pyridin-4-ylpiperidine-4-carbonyl)amino]propan-2-yl]carbamate Traditional Name: N-[1-benzyl-2-[[1-(4-pyridyl)isonipecotoyl]amino]ethyl]carbamic acid tert-butyl ester Formula: C25H34N4O3 MolecularWeight: 438.56246

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CC1=CC=CC=C1)CNC(=O)C2CCN(CC2)C3=CC=NC=C3

Isomeric SMILES

CC(C)(C)OC(=O)NC(CC1=CC=CC=C1)CNC(=O)C2CCN(CC2)C3=CC=NC=C3

InChI

InChI=1S/C25H34N4O3/c1-25(2,3)32-24(31)28-21(17-19-7-5-4-6-8-19)18-27-23(30)20-11-15-29(16-12-20)22-9-13-26-14-10-22/h4-10,13-14,20-21H,11-12,15-18H2,1-3H3,(H,27,30)(H,28,31)