methyl 4-cyano-5-ethyl-2-(2-methoxycarbonylphenyl)-3-oxidanylidene-4H-pyridazin-2-ium-6-carboxylate

Systemtic Name: methyl 4-cyano-5-ethyl-2-(2-methoxycarbonylphenyl)-3-oxidanylidene-4H-pyridazin-2-ium-6-carboxylate Openeye Name: methyl 4-cyano-5-ethyl-2-(2-methoxycarbonylphenyl)-3-oxo-4H-pyridazin-2-ium-6-carboxylate CAS Name: 4-cyano-5-ethyl-2-(2-methoxycarbonylphenyl)-3-oxo-4H-pyridazin-2-ium-6-carboxylic acid methyl ester IUPAC Name: methyl 4-cyano-5-ethyl-2-(2-methoxycarbonylphenyl)-3-oxo-4H-pyridazin-2-ium-6-carboxylate Traditional Name: 2-(2-carbomethoxyphenyl)-4-cyano-5-ethyl-3-keto-4H-pyridazin-2-ium-6-carboxylic acid methyl ester Formula: C17H16N3O5+ MolecularWeight: 342.32604

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(N=[N+](C(=O)C1C#N)C2=CC=CC=C2C(=O)OC)C(=O)OC

Isomeric SMILES

CCC1=C(N=[N+](C(=O)C1C#N)C2=CC=CC=C2C(=O)OC)C(=O)OC

InChI

InChI=1S/C17H16N3O5/c1-4-10-12(9-18)15(21)20(19-14(10)17(23)25-3)13-8-6-5-7-11(13)16(22)24-2/h5-8,12H,4H2,1-3H3/q+1