2,6-bis(chloranyl)-1-fluoranyl-pyridin-1-ium; tris(fluoranyl)methanesulfonate

Systemtic Name: 2,6-bis(chloranyl)-1-fluoranyl-pyridin-1-ium; tris(fluoranyl)methanesulfonate Openeye Name: 2,6-dichloro-1-fluoranyl-pyridin-1-ium; trifluoromethanesulfonate CAS Name: 2,6-dichloro-1-fluoranylpyridin-1-ium; trifluoromethanesulfonate IUPAC Name: 2,6-dichloro-1-fluoranylpyridin-1-ium; trifluoromethanesulfonate Traditional Name: 2,6-dichloro-1-fluoranyl-pyridin-1-ium triflate Formula: C6H3Cl2F4NO3S MolecularWeight: 315.060067

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=[N+](C(=C1)Cl)F)Cl.C(F)(F)(F)S(=O)(=O)[O-]

Isomeric SMILES

C1=CC(=[N+](C(=C1)Cl)[18F])Cl.C(F)(F)(F)S(=O)(=O)[O-]

InChI

InChI=1S/C5H3Cl2FN.CHF3O3S/c6-4-2-1-3-5(7)9(4)8;2-1(3,4)8(5,6)7/h1-3H;(H,5,6,7)/q+1;/p-1/i8-1;