2-fluoranyl-3-(methoxymethyl)-1-(phenylmethyl)pyridin-1-ium; tris(fluoranyl)methanesulfonate

Systemtic Name: 2-fluoranyl-3-(methoxymethyl)-1-(phenylmethyl)pyridin-1-ium; tris(fluoranyl)methanesulfonate Openeye Name: 1-benzyl-2-fluoro-3-(methoxymethyl)pyridin-1-ium; trifluoromethanesulfonate CAS Name: 2-fluoro-3-(methoxymethyl)-1-(phenylmethyl)pyridin-1-ium; trifluoromethanesulfonate IUPAC Name: 1-benzyl-2-fluoro-3-(methoxymethyl)pyridin-1-ium; trifluoromethanesulfonate Traditional Name: 1-benzyl-2-fluoro-3-(methoxymethyl)pyridin-1-ium triflate Formula: C15H15F4NO4S MolecularWeight: 381.342513

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Descriptors Computed from Structure

Canonical SMILES:

COCC1=C([N+](=CC=C1)CC2=CC=CC=C2)F.C(F)(F)(F)S(=O)(=O)[O-]

Isomeric SMILES

COCC1=C([N+](=CC=C1)CC2=CC=CC=C2)F.C(F)(F)(F)S(=O)(=O)[O-]

InChI

InChI=1S/C14H15FNO.CHF3O3S/c1-17-11-13-8-5-9-16(14(13)15)10-12-6-3-2-4-7-12;2-1(3,4)8(5,6)7/h2-9H,10-11H2,1H3;(H,5,6,7)/q+1;/p-1