ethyl 1-[2-(5-cyano-3,4-dimethyl-6-oxidanylidene-pyridazin-1-yl)ethanoyl]piperidine-4-carboxylate

Systemtic Name: ethyl 1-[2-(5-cyano-3,4-dimethyl-6-oxidanylidene-pyridazin-1-yl)ethanoyl]piperidine-4-carboxylate Openeye Name: ethyl 1-[2-(5-cyano-3,4-dimethyl-6-oxo-pyridazin-1-yl)acetyl]piperidine-4-carboxylate CAS Name: 1-[2-(5-cyano-3,4-dimethyl-6-oxo-1-pyridazinyl)-1-oxoethyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[2-(5-cyano-3,4-dimethyl-6-oxopyridazin-1-yl)acetyl]piperidine-4-carboxylate Traditional Name: 1-[2-(5-cyano-6-keto-3,4-dimethyl-pyridazin-1-yl)acetyl]isonipecotic acid ethyl ester Formula: C17H22N4O4 MolecularWeight: 346.38098

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C(=O)CN2C(=O)C(=C(C(=N2)C)C)C#N

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C(=O)CN2C(=O)C(=C(C(=N2)C)C)C#N

InChI

InChI=1S/C17H22N4O4/c1-4-25-17(24)13-5-7-20(8-6-13)15(22)10-21-16(23)14(9-18)11(2)12(3)19-21/h13H,4-8,10H2,1-3H3