cyclopentane; 2-pyridin-2-ylpyridine; titanium(4+); tris(fluoranyl)methanesulfonic acid

Systemtic Name: cyclopentane; 2-pyridin-2-ylpyridine; titanium(4+); tris(fluoranyl)methanesulfonic acid Openeye Name: cyclopentane; 2-(2-pyridyl)pyridine; titanium(4+); trifluoromethanesulfonic acid CAS Name: cyclopentane; 2-(2-pyridinyl)pyridine; titanium(4+); trifluoromethanesulfonic acid IUPAC Name: cyclopentane; 2-pyridin-2-ylpyridine; titanium(4+); trifluoromethanesulfonic acid Traditional Name: cyclopentane; 2-(2-pyridyl)pyridine; titanium(4+); triflic acid Formula: C21H19F3N2O3STi+4 MolecularWeight: 484.31437

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=NC(=C1)C2=CC=CC=N2.[CH]1[CH][CH][CH][CH]1.[CH]1[CH][CH][CH][CH]1.C(F)(F)(F)S(=O)(=O)O.[Ti+4]

Isomeric SMILES

C1=CC=NC(=C1)C2=CC=CC=N2.[CH]1[CH][CH][CH][CH]1.[CH]1[CH][CH][CH][CH]1.C(F)(F)(F)S(=O)(=O)O.[Ti+4]

InChI

InChI=1S/C10H8N2.2C5H5.CHF3O3S.Ti/c1-3-7-11-9(5-1)10-6-2-4-8-12-10;2*1-2-4-5-3-1;2-1(3,4)8(5,6)7;/h1-8H;2*1-5H;(H,5,6,7);/q;;;;+4