ethyl 4-[(4-methyl-3-nitro-phenyl)carbonylamino]-6-oxidanylidene-1-phenyl-pyridazine-3-carboxylate

Systemtic Name: ethyl 4-[(4-methyl-3-nitro-phenyl)carbonylamino]-6-oxidanylidene-1-phenyl-pyridazine-3-carboxylate Openeye Name: ethyl 4-[(4-methyl-3-nitro-benzoyl)amino]-6-oxo-1-phenyl-pyridazine-3-carboxylate CAS Name: 4-[[(4-methyl-3-nitrophenyl)-oxomethyl]amino]-6-oxo-1-phenyl-3-pyridazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[(4-methyl-3-nitrobenzoyl)amino]-6-oxo-1-phenylpyridazine-3-carboxylate Traditional Name: 6-keto-4-[(4-methyl-3-nitro-benzoyl)amino]-1-phenyl-pyridazine-3-carboxylic acid ethyl ester Formula: C21H18N4O6 MolecularWeight: 422.39082

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NN(C(=O)C=C1NC(=O)C2=CC(=C(C=C2)C)[N+](=O)[O-])C3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1=NN(C(=O)C=C1NC(=O)C2=CC(=C(C=C2)C)[N+](=O)[O-])C3=CC=CC=C3

InChI

InChI=1S/C21H18N4O6/c1-3-31-21(28)19-16(12-18(26)24(23-19)15-7-5-4-6-8-15)22-20(27)14-10-9-13(2)17(11-14)25(29)30/h4-12H,3H2,1-2H3,(H,22,27)