1-[(2,3-diethylphenyl)methyl]pyridin-1-ium; tris(fluoranyl)methanesulfonate

Systemtic Name: 1-[(2,3-diethylphenyl)methyl]pyridin-1-ium; tris(fluoranyl)methanesulfonate Openeye Name: 1-[(2,3-diethylphenyl)methyl]pyridin-1-ium; trifluoromethanesulfonate CAS Name: 1-[(2,3-diethylphenyl)methyl]pyridin-1-ium; trifluoromethanesulfonate IUPAC Name: 1-[(2,3-diethylphenyl)methyl]pyridin-1-ium; trifluoromethanesulfonate Traditional Name: 1-(2,3-diethylbenzyl)pyridin-1-ium triflate Formula: C17H20F3NO3S MolecularWeight: 375.40581

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=CC=C1)C[N+]2=CC=CC=C2)CC.C(F)(F)(F)S(=O)(=O)[O-]

Isomeric SMILES

CCC1=C(C(=CC=C1)C[N+]2=CC=CC=C2)CC.C(F)(F)(F)S(=O)(=O)[O-]

InChI

InChI=1S/C16H20N.CHF3O3S/c1-3-14-9-8-10-15(16(14)4-2)13-17-11-6-5-7-12-17;2-1(3,4)8(5,6)7/h5-12H,3-4,13H2,1-2H3;(H,5,6,7)/q+1;/p-1