1-butyl-1-octyl-urea; tris(fluoranyl)methanesulfonate

Systemtic Name: 1-butyl-1-octyl-urea; tris(fluoranyl)methanesulfonate Openeye Name: 1-butyl-1-octyl-urea; trifluoromethanesulfonate CAS Name: 1-butyl-1-octylurea; trifluoromethanesulfonate IUPAC Name: 1-butyl-1-octylurea; trifluoromethanesulfonate Traditional Name: 1-butyl-1-octyl-urea triflate Formula: C14H28F3N2O4S- MolecularWeight: 377.44333

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H28N2O.CHF3O3S/c1-3-5-7-8-9-10-12-15(13(14)16)11-6-4-2;2-1(3,4)8(5,6)7/h3-12H2,1-2H3,(H2,14,16);(H,5,6,7)/p-1