methyl 1-(1-cyanobutan-2-yl)piperidine-4-carboxylate

Systemtic Name: methyl 1-(1-cyanobutan-2-yl)piperidine-4-carboxylate Openeye Name: methyl 1-[1-(cyanomethyl)propyl]piperidine-4-carboxylate CAS Name: 1-(1-cyanobutan-2-yl)-4-piperidinecarboxylic acid methyl ester IUPAC Name: methyl 1-(1-cyanobutan-2-yl)piperidine-4-carboxylate Traditional Name: 1-[1-(cyanomethyl)propyl]isonipecotic acid methyl ester Formula: C12H20N2O2 MolecularWeight: 224.2994

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC#N)N1CCC(CC1)C(=O)OC

Isomeric SMILES

CCC(CC#N)N1CCC(CC1)C(=O)OC

InChI

InChI=1S/C12H20N2O2/c1-3-11(4-7-13)14-8-5-10(6-9-14)12(15)16-2/h10-11H,3-6,8-9H2,1-2H3