ethyl 1-[2-[(1-cyano-1-cyclopropyl-ethyl)amino]-2-oxidanylidene-ethyl]piperidine-3-carboxylate

Systemtic Name: ethyl 1-[2-[(1-cyano-1-cyclopropyl-ethyl)amino]-2-oxidanylidene-ethyl]piperidine-3-carboxylate Openeye Name: ethyl 1-[2-[(1-cyano-1-cyclopropyl-ethyl)amino]-2-oxo-ethyl]piperidine-3-carboxylate CAS Name: 1-[2-[(1-cyano-1-cyclopropylethyl)amino]-2-oxoethyl]-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[2-[(1-cyano-1-cyclopropylethyl)amino]-2-oxoethyl]piperidine-3-carboxylate Traditional Name: 1-[2-[(1-cyano-1-cyclopropyl-ethyl)amino]-2-keto-ethyl]nipecotic acid ethyl ester Formula: C16H25N3O3 MolecularWeight: 307.388

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCN(C1)CC(=O)NC(C)(C#N)C2CC2

Isomeric SMILES

CCOC(=O)C1CCCN(C1)CC(=O)NC(C)(C#N)C2CC2

InChI

InChI=1S/C16H25N3O3/c1-3-22-15(21)12-5-4-8-19(9-12)10-14(20)18-16(2,11-17)13-6-7-13/h12-13H,3-10H2,1-2H3,(H,18,20)