(6-nitrobenzotriazol-1-yl)oxy-tripyrrolidin-1-yl-phosphanium hexafluorophosphate

Systemtic Name: (6-nitrobenzotriazol-1-yl)oxy-tripyrrolidin-1-yl-phosphanium hexafluorophosphate Openeye Name: (6-nitrobenzotriazol-1-yl)oxy-tripyrrolidin-1-yl-phosphonium hexafluorophosphate CAS Name: (6-nitro-1-benzotriazolyl)oxy-tris(1-pyrrolidinyl)phosphonium hexafluorophosphate IUPAC Name: (6-nitrobenzotriazol-1-yl)oxy-tripyrrolidin-1-ylphosphanium hexafluorophosphate Traditional Name: (6-nitrobenzotriazol-1-yl)oxy-tripyrrolidino-phosphonium hexafluorophosphate Formula: C18H27F6N7O3P2 MolecularWeight: 565.390021

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H27N7O3P.F6P/c26-25(27)16-7-8-17-18(15-16)24(20-19-17)28-29(21-9-1-2-10-21,22-11-3-4-12-22)23-13-5-6-14-23;1-7(2,3,4,5)6/h7-8,15H,1-6,9-14H2;/q+1;-1