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

Systemtic Name: methyl 1-[2-(5-cyano-3,4-dimethyl-6-oxidanylidene-pyridazin-1-yl)ethanoyl]piperidine-4-carboxylate Openeye Name: methyl 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 methyl ester IUPAC Name: methyl 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 methyl ester Formula: C16H20N4O4 MolecularWeight: 332.3544

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N=C1C)CC(=O)N2CCC(CC2)C(=O)OC)C#N

Isomeric SMILES

CC1=C(C(=O)N(N=C1C)CC(=O)N2CCC(CC2)C(=O)OC)C#N

InChI

InChI=1S/C16H20N4O4/c1-10-11(2)18-20(15(22)13(10)8-17)9-14(21)19-6-4-12(5-7-19)16(23)24-3/h12H,4-7,9H2,1-3H3