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

Systemtic Name: methyl 5-cyano-4-ethyl-1-(4-methylphenyl)-6-oxidanylidene-pyridazine-3-carboxylate Openeye Name: methyl 5-cyano-4-ethyl-6-oxo-1-(p-tolyl)pyridazine-3-carboxylate CAS Name: 5-cyano-4-ethyl-1-(4-methylphenyl)-6-oxo-3-pyridazinecarboxylic acid methyl ester IUPAC Name: methyl 5-cyano-4-ethyl-1-(4-methylphenyl)-6-oxopyridazine-3-carboxylate Traditional Name: 5-cyano-4-ethyl-6-keto-1-(p-tolyl)pyridazine-3-carboxylic acid methyl ester Formula: C16H15N3O3 MolecularWeight: 297.3086

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=O)N(N=C1C(=O)OC)C2=CC=C(C=C2)C)C#N

Isomeric SMILES

CCC1=C(C(=O)N(N=C1C(=O)OC)C2=CC=C(C=C2)C)C#N

InChI

InChI=1S/C16H15N3O3/c1-4-12-13(9-17)15(20)19(18-14(12)16(21)22-3)11-7-5-10(2)6-8-11/h5-8H,4H2,1-3H3