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

Systemtic Name: [4-nitro-6-(trifluoromethyl)benzotriazol-1-yl]oxy-tripyrrolidin-1-yl-phosphanium hexafluorophosphate Openeye Name: [4-nitro-6-(trifluoromethyl)benzotriazol-1-yl]oxy-tripyrrolidin-1-yl-phosphonium hexafluorophosphate CAS Name: [4-nitro-6-(trifluoromethyl)-1-benzotriazolyl]oxy-tris(1-pyrrolidinyl)phosphonium hexafluorophosphate IUPAC Name: [4-nitro-6-(trifluoromethyl)benzotriazol-1-yl]oxy-tripyrrolidin-1-ylphosphanium hexafluorophosphate Traditional Name: [4-nitro-6-(trifluoromethyl)benzotriazol-1-yl]oxy-tripyrrolidino-phosphonium hexafluorophosphate Formula: C19H26F9N7O3P2 MolecularWeight: 633.387991

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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+](=O)[O-])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+](=O)[O-])N=N4.F[P-](F)(F)(F)(F)F

InChI

InChI=1S/C19H26F3N7O3P.F6P/c20-19(21,22)15-13-16-18(17(14-15)29(30)31)23-24-28(16)32-33(25-7-1-2-8-25,26-9-3-4-10-26)27-11-5-6-12-27;1-7(2,3,4,5)6/h13-14H,1-12H2;/q+1;-1