methyl 6-oxidanyl-4-oxidanylidene-1-[2-(trifluoromethyl)phenyl]pyridazine-3-carboxylate

Systemtic Name: methyl 6-oxidanyl-4-oxidanylidene-1-[2-(trifluoromethyl)phenyl]pyridazine-3-carboxylate Openeye Name: methyl 6-hydroxy-4-oxo-1-[2-(trifluoromethyl)phenyl]pyridazine-3-carboxylate CAS Name: 6-hydroxy-4-oxo-1-[2-(trifluoromethyl)phenyl]-3-pyridazinecarboxylic acid methyl ester IUPAC Name: methyl 6-hydroxy-4-oxo-1-[2-(trifluoromethyl)phenyl]pyridazine-3-carboxylate Traditional Name: 6-hydroxy-4-keto-1-[2-(trifluoromethyl)phenyl]pyridazine-3-carboxylic acid methyl ester Formula: C13H9F3N2O4 MolecularWeight: 314.21677

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=NN(C(=CC1=O)O)C2=CC=CC=C2C(F)(F)F

Isomeric SMILES

COC(=O)C1=NN(C(=CC1=O)O)C2=CC=CC=C2C(F)(F)F

InChI

InChI=1S/C13H9F3N2O4/c1-22-12(21)11-9(19)6-10(20)18(17-11)8-5-3-2-4-7(8)13(14,15)16/h2-6,20H,1H3