tributyl-(N,N,N'-tributylcarbamimidoyl)azanium; tris(fluoranyl)methanesulfonate

Systemtic Name: tributyl-(N,N,N'-tributylcarbamimidoyl)azanium; tris(fluoranyl)methanesulfonate Openeye Name: tributyl-(N,N,N'-tributylcarbamimidoyl)ammonium; trifluoromethanesulfonate CAS Name: tributyl-[butylimino-(dibutylamino)methyl]ammonium; trifluoromethanesulfonate IUPAC Name: tributyl-(N,N,N'-tributylcarbamimidoyl)azanium; trifluoromethanesulfonate Traditional Name: tributyl-(N,N,N'-tributylamidino)ammonium triflate Formula: C26H54F3N3O3S MolecularWeight: 545.78547

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCN=C(N(CCCC)CCCC)[N+](CCCC)(CCCC)CCCC.C(F)(F)(F)S(=O)(=O)[O-]

Isomeric SMILES

CCCCN=C(N(CCCC)CCCC)[N+](CCCC)(CCCC)CCCC.C(F)(F)(F)S(=O)(=O)[O-]

InChI

InChI=1S/C25H54N3.CHF3O3S/c1-7-13-19-26-25(27(20-14-8-2)21-15-9-3)28(22-16-10-4,23-17-11-5)24-18-12-6;2-1(3,4)8(5,6)7/h7-24H2,1-6H3;(H,5,6,7)/q+1;/p-1