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

Systemtic Name: ethyl 5-cyano-1-(3,4-dimethylphenyl)-4-methyl-6-oxidanylidene-pyridazine-3-carboxylate Openeye Name: ethyl 5-cyano-1-(3,4-dimethylphenyl)-4-methyl-6-oxo-pyridazine-3-carboxylate CAS Name: 5-cyano-1-(3,4-dimethylphenyl)-4-methyl-6-oxo-3-pyridazinecarboxylic acid ethyl ester IUPAC Name: ethyl 5-cyano-1-(3,4-dimethylphenyl)-4-methyl-6-oxopyridazine-3-carboxylate Traditional Name: 5-cyano-1-(3,4-dimethylphenyl)-6-keto-4-methyl-pyridazine-3-carboxylic acid ethyl ester Formula: C17H17N3O3 MolecularWeight: 311.33518

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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)C)C

Isomeric SMILES

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

InChI

InChI=1S/C17H17N3O3/c1-5-23-17(22)15-12(4)14(9-18)16(21)20(19-15)13-7-6-10(2)11(3)8-13/h6-8H,5H2,1-4H3