tert-butyl (4-pyridin-2-ylpiperidin-1-yl) carbonate; piperidine-3-carboxamide

Systemtic Name: tert-butyl (4-pyridin-2-ylpiperidin-1-yl) carbonate; piperidine-3-carboxamide Openeye Name: tert-butyl [4-(2-pyridyl)-1-piperidyl] carbonate; piperidine-3-carboxamide CAS Name: carbonic acid tert-butyl [4-(2-pyridinyl)-1-piperidinyl] ester; 3-piperidinecarboxamide IUPAC Name: tert-butyl (4-pyridin-2-ylpiperidin-1-yl) carbonate; piperidine-3-carboxamide Traditional Name: carbonic acid tert-butyl [4-(2-pyridyl)piperidino] ester; nipecotamide Formula: C21H34N4O4 MolecularWeight: 406.51906

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)ON1CCC(CC1)C2=CC=CC=N2.C1CC(CNC1)C(=O)N

Isomeric SMILES

CC(C)(C)OC(=O)ON1CCC(CC1)C2=CC=CC=N2.C1CC(CNC1)C(=O)N

InChI

InChI=1S/C15H22N2O3.C6H12N2O/c1-15(2,3)19-14(18)20-17-10-7-12(8-11-17)13-6-4-5-9-16-13;7-6(9)5-2-1-3-8-4-5/h4-6,9,12H,7-8,10-11H2,1-3H3;5,8H,1-4H2,(H2,7,9)