5-methyl-2-phenyl-4-[2,2,2-tris(fluoranyl)ethanoyl]pyrazol-3-olate

Systemtic Name: 5-methyl-2-phenyl-4-[2,2,2-tris(fluoranyl)ethanoyl]pyrazol-3-olate Openeye Name: 5-methyl-2-phenyl-4-(2,2,2-trifluoroacetyl)pyrazol-3-olate CAS Name: 5-methyl-2-phenyl-4-(2,2,2-trifluoro-1-oxoethyl)-3-pyrazololate IUPAC Name: 5-methyl-2-phenyl-4-(2,2,2-trifluoroacetyl)pyrazol-3-olate Traditional Name: 5-methyl-2-phenyl-4-(2,2,2-trifluoroacetyl)pyrazol-3-olate Formula: C12H8F3N2O2- MolecularWeight: 269.19933

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C(=O)C(F)(F)F)[O-])C2=CC=CC=C2

Isomeric SMILES

CC1=NN(C(=C1C(=O)C(F)(F)F)[O-])C2=CC=CC=C2

InChI

InChI=1S/C12H9F3N2O2/c1-7-9(10(18)12(13,14)15)11(19)17(16-7)8-5-3-2-4-6-8/h2-6,19H,1H3/p-1