ethyl 1-[2-(2-cyanoethylamino)-2-oxidanylidene-ethyl]piperidine-3-carboxylate

Systemtic Name: ethyl 1-[2-(2-cyanoethylamino)-2-oxidanylidene-ethyl]piperidine-3-carboxylate Openeye Name: ethyl 1-[2-(2-cyanoethylamino)-2-oxo-ethyl]piperidine-3-carboxylate CAS Name: 1-[2-(2-cyanoethylamino)-2-oxoethyl]-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[2-(2-cyanoethylamino)-2-oxoethyl]piperidine-3-carboxylate Traditional Name: 1-[2-(2-cyanoethylamino)-2-keto-ethyl]nipecotic acid ethyl ester Formula: C13H21N3O3 MolecularWeight: 267.32414

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H21N3O3/c1-2-19-13(18)11-5-3-8-16(9-11)10-12(17)15-7-4-6-14/h11H,2-5,7-10H2,1H3,(H,15,17)