ethyl (3S)-1-(2-cyanoethanoyl)piperidine-3-carboxylate

Systemtic Name: ethyl (3S)-1-(2-cyanoethanoyl)piperidine-3-carboxylate Openeye Name: ethyl (3S)-1-(2-cyanoacetyl)piperidine-3-carboxylate CAS Name: (3S)-1-(2-cyano-1-oxoethyl)-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl (3S)-1-(2-cyanoacetyl)piperidine-3-carboxylate Traditional Name: (3S)-1-(2-cyanoacetyl)nipecotic acid ethyl ester Formula: C11H16N2O3 MolecularWeight: 224.25634

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCN(C1)C(=O)CC#N

Isomeric SMILES

CCOC(=O)[C@H]1CCCN(C1)C(=O)CC#N

InChI

InChI=1S/C11H16N2O3/c1-2-16-11(15)9-4-3-7-13(8-9)10(14)5-6-12/h9H,2-5,7-8H2,1H3/t9-/m0/s1