tert-butyl N-[1-(1-pyridin-4-ylpiperidin-4-yl)carbonylpyrrolidin-3-yl]carbamate

Systemtic Name: tert-butyl N-[1-(1-pyridin-4-ylpiperidin-4-yl)carbonylpyrrolidin-3-yl]carbamate Openeye Name: tert-butyl N-[1-[1-(4-pyridyl)piperidine-4-carbonyl]pyrrolidin-3-yl]carbamate CAS Name: N-[1-[oxo-(1-pyridin-4-yl-4-piperidinyl)methyl]-3-pyrrolidinyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[1-(1-pyridin-4-ylpiperidine-4-carbonyl)pyrrolidin-3-yl]carbamate Traditional Name: N-[1-[1-(4-pyridyl)isonipecotoyl]pyrrolidin-3-yl]carbamic acid tert-butyl ester Formula: C20H30N4O3 MolecularWeight: 374.4772

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC1CCN(C1)C(=O)C2CCN(CC2)C3=CC=NC=C3

Isomeric SMILES

CC(C)(C)OC(=O)NC1CCN(C1)C(=O)C2CCN(CC2)C3=CC=NC=C3

InChI

InChI=1S/C20H30N4O3/c1-20(2,3)27-19(26)22-16-8-13-24(14-16)18(25)15-6-11-23(12-7-15)17-4-9-21-10-5-17/h4-5,9-10,15-16H,6-8,11-14H2,1-3H3,(H,22,26)