ethyl 6-oxidanylidene-1-phenyl-4-[[2-(trifluoromethyl)phenyl]carbonylamino]pyridazine-3-carboxylate

Systemtic Name: ethyl 6-oxidanylidene-1-phenyl-4-[[2-(trifluoromethyl)phenyl]carbonylamino]pyridazine-3-carboxylate Openeye Name: ethyl 6-oxo-1-phenyl-4-[[2-(trifluoromethyl)benzoyl]amino]pyridazine-3-carboxylate CAS Name: 6-oxo-4-[[oxo-[2-(trifluoromethyl)phenyl]methyl]amino]-1-phenyl-3-pyridazinecarboxylic acid ethyl ester IUPAC Name: ethyl 6-oxo-1-phenyl-4-[[2-(trifluoromethyl)benzoyl]amino]pyridazine-3-carboxylate Traditional Name: 6-keto-1-phenyl-4-[[2-(trifluoromethyl)benzoyl]amino]pyridazine-3-carboxylic acid ethyl ester Formula: C21H16F3N3O4 MolecularWeight: 431.36465

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NN(C(=O)C=C1NC(=O)C2=CC=CC=C2C(F)(F)F)C3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1=NN(C(=O)C=C1NC(=O)C2=CC=CC=C2C(F)(F)F)C3=CC=CC=C3

InChI

InChI=1S/C21H16F3N3O4/c1-2-31-20(30)18-16(12-17(28)27(26-18)13-8-4-3-5-9-13)25-19(29)14-10-6-7-11-15(14)21(22,23)24/h3-12H,2H2,1H3,(H,25,29)