2-(4-fluoranylbenzene-6-id-1-yl)-4-methoxy-pyridine; iridium; pyridin-2-ylmethyl(trifluoromethylsulfonyl)azanide

Systemtic Name: 2-(4-fluoranylbenzene-6-id-1-yl)-4-methoxy-pyridine; iridium; pyridin-2-ylmethyl(trifluoromethylsulfonyl)azanide Openeye Name: 2-(4-fluorobenzene-6-id-1-yl)-4-methoxy-pyridine; iridium; 2-pyridylmethyl(trifluoromethylsulfonyl)azanide CAS Name: 2-(4-fluoro-1-benzene-6-idyl)-4-methoxypyridine; iridium; 2-pyridinylmethyl(trifluoromethylsulfonyl)azanide IUPAC Name: 2-(4-fluorobenzene-6-id-1-yl)-4-methoxypyridine; iridium; pyridin-2-ylmethyl(trifluoromethylsulfonyl)azanide Traditional Name: 2-(4-fluorobenzene-6-id-1-yl)-4-methoxy-pyridine; iridium; 2-pyridylmethyl(triflyl)azanide Formula: C19H15F4IrN3O3S-2 MolecularWeight: 633.616313

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=NC=C1)C2=CC=C(C=[C-]2)F.C1=CC=NC(=C1)C[N-]S(=O)(=O)C(F)(F)F.[Ir]

Isomeric SMILES

COC1=CC(=NC=C1)C2=CC=C(C=[C-]2)F.C1=CC=NC(=C1)C[N-]S(=O)(=O)C(F)(F)F.[Ir]

InChI

InChI=1S/C12H9FNO.C7H6F3N2O2S.Ir/c1-15-11-6-7-14-12(8-11)9-2-4-10(13)5-3-9;8-7(9,10)15(13,14)12-5-6-3-1-2-4-11-6;/h2,4-8H,1H3;1-4H,5H2;/q2*-1;