4-[[(5-cyano-4-methyl-6-oxidanylidene-1-phenyl-pyridazin-3-yl)carbonylhydrazinylidene]methyl]benzoate

Systemtic Name: 4-[[(5-cyano-4-methyl-6-oxidanylidene-1-phenyl-pyridazin-3-yl)carbonylhydrazinylidene]methyl]benzoate Openeye Name: 4-[[(5-cyano-4-methyl-6-oxo-1-phenyl-pyridazine-3-carbonyl)hydrazono]methyl]benzoate CAS Name: 4-[[[(5-cyano-4-methyl-6-oxo-1-phenyl-3-pyridazinyl)-oxomethyl]hydrazinylidene]methyl]benzoate IUPAC Name: 4-[[(5-cyano-4-methyl-6-oxo-1-phenylpyridazine-3-carbonyl)hydrazinylidene]methyl]benzoate Traditional Name: 4-[[(5-cyano-6-keto-4-methyl-1-phenyl-pyridazine-3-carbonyl)hydrazono]methyl]benzoate Formula: C21H14N5O4- MolecularWeight: 400.36696

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N=C1C(=O)NN=CC2=CC=C(C=C2)C(=O)[O-])C3=CC=CC=C3)C#N

Isomeric SMILES

CC1=C(C(=O)N(N=C1C(=O)NN=CC2=CC=C(C=C2)C(=O)[O-])C3=CC=CC=C3)C#N

InChI

InChI=1S/C21H15N5O4/c1-13-17(11-22)20(28)26(16-5-3-2-4-6-16)25-18(13)19(27)24-23-12-14-7-9-15(10-8-14)21(29)30/h2-10,12H,1H3,(H,24,27)(H,29,30)/p-1