methyl 1-(5-cyanopyridin-2-yl)piperidine-4-carboxylate

Systemtic Name: methyl 1-(5-cyanopyridin-2-yl)piperidine-4-carboxylate Openeye Name: methyl 1-(5-cyano-2-pyridyl)piperidine-4-carboxylate CAS Name: 1-(5-cyano-2-pyridinyl)-4-piperidinecarboxylic acid methyl ester IUPAC Name: methyl 1-(5-cyanopyridin-2-yl)piperidine-4-carboxylate Traditional Name: 1-(5-cyano-2-pyridyl)isonipecotic acid methyl ester Formula: C13H15N3O2 MolecularWeight: 245.2771

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CCN(CC1)C2=NC=C(C=C2)C#N

Isomeric SMILES

COC(=O)C1CCN(CC1)C2=NC=C(C=C2)C#N

InChI

InChI=1S/C13H15N3O2/c1-18-13(17)11-4-6-16(7-5-11)12-3-2-10(8-14)9-15-12/h2-3,9,11H,4-7H2,1H3