tert-butyl 4-[1-(4-cyanopyridin-2-yl)piperidin-4-yl]piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[1-(4-cyanopyridin-2-yl)piperidin-4-yl]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[1-(4-cyano-2-pyridyl)-4-piperidyl]piperidine-1-carboxylate CAS Name: 4-[1-(4-cyano-2-pyridinyl)-4-piperidinyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[1-(4-cyanopyridin-2-yl)piperidin-4-yl]piperidine-1-carboxylate Traditional Name: 4-[1-(4-cyano-2-pyridyl)-4-piperidyl]piperidine-1-carboxylic acid tert-butyl ester Formula: C21H30N4O2 MolecularWeight: 370.4885

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(CC1)C2CCN(CC2)C3=NC=CC(=C3)C#N

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(CC1)C2CCN(CC2)C3=NC=CC(=C3)C#N

InChI

InChI=1S/C21H30N4O2/c1-21(2,3)27-20(26)25-12-7-18(8-13-25)17-5-10-24(11-6-17)19-14-16(15-22)4-9-23-19/h4,9,14,17-18H,5-8,10-13H2,1-3H3