2-ethynyl-1-prop-2-ynyl-pyridin-1-ium; tris(fluoranyl)methanesulfonate

Systemtic Name: 2-ethynyl-1-prop-2-ynyl-pyridin-1-ium; tris(fluoranyl)methanesulfonate Openeye Name: 2-ethynyl-1-prop-2-ynyl-pyridin-1-ium; trifluoromethanesulfonate CAS Name: 2-ethynyl-1-prop-2-ynylpyridin-1-ium; trifluoromethanesulfonate IUPAC Name: 2-ethynyl-1-prop-2-ynylpyridin-1-ium; trifluoromethanesulfonate Traditional Name: 2-ethynyl-1-propargyl-pyridin-1-ium triflate Formula: C11H8F3NO3S MolecularWeight: 291.24633

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C#CC[N+]1=CC=CC=C1C#C.C(F)(F)(F)S(=O)(=O)[O-]

Isomeric SMILES

C#CC[N+]1=CC=CC=C1C#C.C(F)(F)(F)S(=O)(=O)[O-]

InChI

InChI=1S/C10H8N.CHF3O3S/c1-3-8-11-9-6-5-7-10(11)4-2;2-1(3,4)8(5,6)7/h1-2,5-7,9H,8H2;(H,5,6,7)/q+1;/p-1