methyl 5-ethoxy-6-oxidanylidene-1-phenyl-3-(trifluoromethyl)pyridazine-4-carboxylate

Systemtic Name: methyl 5-ethoxy-6-oxidanylidene-1-phenyl-3-(trifluoromethyl)pyridazine-4-carboxylate Openeye Name: methyl 5-ethoxy-6-oxo-1-phenyl-3-(trifluoromethyl)pyridazine-4-carboxylate CAS Name: 5-ethoxy-6-oxo-1-phenyl-3-(trifluoromethyl)-4-pyridazinecarboxylic acid methyl ester IUPAC Name: methyl 5-ethoxy-6-oxo-1-phenyl-3-(trifluoromethyl)pyridazine-4-carboxylate Traditional Name: 5-ethoxy-6-keto-1-phenyl-3-(trifluoromethyl)pyridazine-4-carboxylic acid methyl ester Formula: C15H13F3N2O4 MolecularWeight: 342.26993

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=NN(C1=O)C2=CC=CC=C2)C(F)(F)F)C(=O)OC

Isomeric SMILES

CCOC1=C(C(=NN(C1=O)C2=CC=CC=C2)C(F)(F)F)C(=O)OC

InChI

InChI=1S/C15H13F3N2O4/c1-3-24-11-10(14(22)23-2)12(15(16,17)18)19-20(13(11)21)9-7-5-4-6-8-9/h4-8H,3H2,1-2H3