butyl 4-[[6-methyl-1-(2-nitrophenyl)-4-oxidanylidene-pyridazin-3-yl]carbonylamino]benzoate

Systemtic Name: butyl 4-[[6-methyl-1-(2-nitrophenyl)-4-oxidanylidene-pyridazin-3-yl]carbonylamino]benzoate Openeye Name: butyl 4-[[6-methyl-1-(2-nitrophenyl)-4-oxo-pyridazine-3-carbonyl]amino]benzoate CAS Name: 4-[[[6-methyl-1-(2-nitrophenyl)-4-oxo-3-pyridazinyl]-oxomethyl]amino]benzoic acid butyl ester IUPAC Name: butyl 4-[[6-methyl-1-(2-nitrophenyl)-4-oxopyridazine-3-carbonyl]amino]benzoate Traditional Name: 4-[[4-keto-6-methyl-1-(2-nitrophenyl)pyridazine-3-carbonyl]amino]benzoic acid butyl ester Formula: C23H22N4O6 MolecularWeight: 450.44398

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC=C(C=C1)NC(=O)C2=NN(C(=CC2=O)C)C3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

CCCCOC(=O)C1=CC=C(C=C1)NC(=O)C2=NN(C(=CC2=O)C)C3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C23H22N4O6/c1-3-4-13-33-23(30)16-9-11-17(12-10-16)24-22(29)21-20(28)14-15(2)26(25-21)18-7-5-6-8-19(18)27(31)32/h5-12,14H,3-4,13H2,1-2H3,(H,24,29)