ethyne; phenyliodanium; tris(fluoranyl)methanesulfonate

Systemtic Name: ethyne; phenyliodanium; tris(fluoranyl)methanesulfonate Openeye Name: acetylene; phenyliodonium; trifluoromethanesulfonate CAS Name: acetylene; phenyliodonium; trifluoromethanesulfonate IUPAC Name: acetylene; phenyliodanium; trifluoromethanesulfonate Traditional Name: acetylene; phenyliodonium; ditriflate Formula: C18H16F6I2O6S2 MolecularWeight: 760.245399

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Descriptors Computed from Structure

Canonical SMILES:

C#C.C#C.C1=CC=C(C=C1)[IH+].C1=CC=C(C=C1)[IH+].C(F)(F)(F)S(=O)(=O)[O-].C(F)(F)(F)S(=O)(=O)[O-]

Isomeric SMILES

C#C.C#C.C1=CC=C(C=C1)[IH+].C1=CC=C(C=C1)[IH+].C(F)(F)(F)S(=O)(=O)[O-].C(F)(F)(F)S(=O)(=O)[O-]

InChI

InChI=1S/2C6H6I.2C2H2.2CHF3O3S/c2*7-6-4-2-1-3-5-6;2*1-2;2*2-1(3,4)8(5,6)7/h2*1-5,7H;2*1-2H;2*(H,5,6,7)/q2*+1;;;;/p-2