tert-butyl 4-(1-pyrimidin-2-ylpiperidin-4-yl)carbonylpiperazine-1-carboxylate

Systemtic Name: tert-butyl 4-(1-pyrimidin-2-ylpiperidin-4-yl)carbonylpiperazine-1-carboxylate Openeye Name: tert-butyl 4-(1-pyrimidin-2-ylpiperidine-4-carbonyl)piperazine-1-carboxylate CAS Name: 4-[oxo-[1-(2-pyrimidinyl)-4-piperidinyl]methyl]-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-(1-pyrimidin-2-ylpiperidine-4-carbonyl)piperazine-1-carboxylate Traditional Name: 4-[1-(2-pyrimidyl)isonipecotoyl]piperazine-1-carboxylic acid tert-butyl ester Formula: C19H29N5O3 MolecularWeight: 375.46526

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCN(CC1)C(=O)C2CCN(CC2)C3=NC=CC=N3

Isomeric SMILES

CC(C)(C)OC(=O)N1CCN(CC1)C(=O)C2CCN(CC2)C3=NC=CC=N3

InChI

InChI=1S/C19H29N5O3/c1-19(2,3)27-18(26)24-13-11-22(12-14-24)16(25)15-5-9-23(10-6-15)17-20-7-4-8-21-17/h4,7-8,15H,5-6,9-14H2,1-3H3