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

Systemtic Name: ethyl 5-cyano-4-methyl-1-(3-nitrophenyl)-6-oxidanylidene-pyridazine-3-carboxylate Openeye Name: ethyl 5-cyano-4-methyl-1-(3-nitrophenyl)-6-oxo-pyridazine-3-carboxylate CAS Name: 5-cyano-4-methyl-1-(3-nitrophenyl)-6-oxo-3-pyridazinecarboxylic acid ethyl ester IUPAC Name: ethyl 5-cyano-4-methyl-1-(3-nitrophenyl)-6-oxopyridazine-3-carboxylate Traditional Name: 5-cyano-6-keto-4-methyl-1-(3-nitrophenyl)pyridazine-3-carboxylic acid ethyl ester Formula: C15H12N4O5 MolecularWeight: 328.27958

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NN(C(=O)C(=C1C)C#N)C2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=NN(C(=O)C(=C1C)C#N)C2=CC(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C15H12N4O5/c1-3-24-15(21)13-9(2)12(8-16)14(20)18(17-13)10-5-4-6-11(7-10)19(22)23/h4-7H,3H2,1-2H3