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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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