ethyl 5-cyano-1-(4-ethoxyphenyl)-4-methyl-6-oxidanylidene-pyridazine-3-carboxylate

Systemtic Name: ethyl 5-cyano-1-(4-ethoxyphenyl)-4-methyl-6-oxidanylidene-pyridazine-3-carboxylate Openeye Name: ethyl 5-cyano-1-(4-ethoxyphenyl)-4-methyl-6-oxo-pyridazine-3-carboxylate CAS Name: 5-cyano-1-(4-ethoxyphenyl)-4-methyl-6-oxo-3-pyridazinecarboxylic acid ethyl ester IUPAC Name: ethyl 5-cyano-1-(4-ethoxyphenyl)-4-methyl-6-oxopyridazine-3-carboxylate Traditional Name: 5-cyano-6-keto-4-methyl-1-p-phenetyl-pyridazine-3-carboxylic acid ethyl ester Formula: C17H17N3O4 MolecularWeight: 327.33458

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N2C(=O)C(=C(C(=N2)C(=O)OCC)C)C#N

Isomeric SMILES

CCOC1=CC=C(C=C1)N2C(=O)C(=C(C(=N2)C(=O)OCC)C)C#N

InChI

InChI=1S/C17H17N3O4/c1-4-23-13-8-6-12(7-9-13)20-16(21)14(10-18)11(3)15(19-20)17(22)24-5-2/h6-9H,4-5H2,1-3H3