tripyrrolidin-1-yl-[6-(trifluoromethyl)benzotriazol-1-yl]oxy-phosphanium hexafluorophosphate

Systemtic Name: tripyrrolidin-1-yl-[6-(trifluoromethyl)benzotriazol-1-yl]oxy-phosphanium hexafluorophosphate Openeye Name: tripyrrolidin-1-yl-[6-(trifluoromethyl)benzotriazol-1-yl]oxy-phosphonium hexafluorophosphate CAS Name: tris(1-pyrrolidinyl)-[[6-(trifluoromethyl)-1-benzotriazolyl]oxy]phosphonium hexafluorophosphate IUPAC Name: tripyrrolidin-1-yl-[6-(trifluoromethyl)benzotriazol-1-yl]oxyphosphanium hexafluorophosphate Traditional Name: tripyrrolidino-[6-(trifluoromethyl)benzotriazol-1-yl]oxy-phosphonium hexafluorophosphate Formula: C19H27F9N6OP2 MolecularWeight: 588.390431

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)[P+](N2CCCC2)(N3CCCC3)ON4C5=C(C=CC(=C5)C(F)(F)F)N=N4.F[P-](F)(F)(F)(F)F

Isomeric SMILES

C1CCN(C1)[P+](N2CCCC2)(N3CCCC3)ON4C5=C(C=CC(=C5)C(F)(F)F)N=N4.F[P-](F)(F)(F)(F)F

InChI

InChI=1S/C19H27F3N6OP.F6P/c20-19(21,22)16-7-8-17-18(15-16)28(24-23-17)29-30(25-9-1-2-10-25,26-11-3-4-12-26)27-13-5-6-14-27;1-7(2,3,4,5)6/h7-8,15H,1-6,9-14H2;/q+1;-1