methyl 1-[2-(cyanomethylsulfanyl)ethanoyl]piperidine-4-carboxylate

Systemtic Name: methyl 1-[2-(cyanomethylsulfanyl)ethanoyl]piperidine-4-carboxylate Openeye Name: methyl 1-[2-(cyanomethylsulfanyl)acetyl]piperidine-4-carboxylate CAS Name: 1-[2-(cyanomethylthio)-1-oxoethyl]-4-piperidinecarboxylic acid methyl ester IUPAC Name: methyl 1-[2-(cyanomethylsulfanyl)acetyl]piperidine-4-carboxylate Traditional Name: 1-[2-(cyanomethylthio)acetyl]isonipecotic acid methyl ester Formula: C11H16N2O3S MolecularWeight: 256.32134

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CCN(CC1)C(=O)CSCC#N

Isomeric SMILES

COC(=O)C1CCN(CC1)C(=O)CSCC#N

InChI

InChI=1S/C11H16N2O3S/c1-16-11(15)9-2-5-13(6-3-9)10(14)8-17-7-4-12/h9H,2-3,5-8H2,1H3