ethyl 1-pyrimidin-4-ylpiperidine-4-carboxylate

Systemtic Name: ethyl 1-pyrimidin-4-ylpiperidine-4-carboxylate Openeye Name: ethyl 1-pyrimidin-4-ylpiperidine-4-carboxylate CAS Name: 1-(4-pyrimidinyl)-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-pyrimidin-4-ylpiperidine-4-carboxylate Traditional Name: 1-(4-pyrimidyl)isonipecotic acid ethyl ester Formula: C12H17N3O2 MolecularWeight: 235.28228

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C2=NC=NC=C2

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C2=NC=NC=C2

InChI

InChI=1S/C12H17N3O2/c1-2-17-12(16)10-4-7-15(8-5-10)11-3-6-13-9-14-11/h3,6,9-10H,2,4-5,7-8H2,1H3