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

Systemtic Name: ethyl 1-(3-chloranyl-4-methyl-phenyl)-5-cyano-4-methyl-6-oxidanylidene-pyridazine-3-carboxylate Openeye Name: ethyl 1-(3-chloro-4-methyl-phenyl)-5-cyano-4-methyl-6-oxo-pyridazine-3-carboxylate CAS Name: 1-(3-chloro-4-methylphenyl)-5-cyano-4-methyl-6-oxo-3-pyridazinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(3-chloro-4-methylphenyl)-5-cyano-4-methyl-6-oxopyridazine-3-carboxylate Traditional Name: 1-(3-chloro-4-methyl-phenyl)-5-cyano-6-keto-4-methyl-pyridazine-3-carboxylic acid ethyl ester Formula: C16H14ClN3O3 MolecularWeight: 331.75366

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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)Cl

Isomeric SMILES

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

InChI

InChI=1S/C16H14ClN3O3/c1-4-23-16(22)14-10(3)12(8-18)15(21)20(19-14)11-6-5-9(2)13(17)7-11/h5-7H,4H2,1-3H3