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

Systemtic Name: ethyl 5-cyano-1-(4-methoxyphenyl)-4-methyl-6-oxidanylidene-pyridazine-3-carboxylate Openeye Name: ethyl 5-cyano-1-(4-methoxyphenyl)-4-methyl-6-oxo-pyridazine-3-carboxylate CAS Name: 5-cyano-1-(4-methoxyphenyl)-4-methyl-6-oxo-3-pyridazinecarboxylic acid ethyl ester IUPAC Name: ethyl 5-cyano-1-(4-methoxyphenyl)-4-methyl-6-oxopyridazine-3-carboxylate Traditional Name: 5-cyano-6-keto-1-(4-methoxyphenyl)-4-methyl-pyridazine-3-carboxylic acid ethyl ester Formula: C16H15N3O4 MolecularWeight: 313.308

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NN(C(=O)C(=C1C)C#N)C2=CC=C(C=C2)OC

Isomeric SMILES

CCOC(=O)C1=NN(C(=O)C(=C1C)C#N)C2=CC=C(C=C2)OC

InChI

InChI=1S/C16H15N3O4/c1-4-23-16(21)14-10(2)13(9-17)15(20)19(18-14)11-5-7-12(22-3)8-6-11/h5-8H,4H2,1-3H3