tris(diethylamino)-[1,1,1,3,3,3-hexakis(fluoranyl)-2-phenyl-propan-2-yl]oxy-phosphanium bromide

Systemtic Name: tris(diethylamino)-[1,1,1,3,3,3-hexakis(fluoranyl)-2-phenyl-propan-2-yl]oxy-phosphanium bromide Openeye Name: tris(diethylamino)-[2,2,2-trifluoro-1-phenyl-1-(trifluoromethyl)ethoxy]phosphonium bromide CAS Name: tris(diethylamino)-(1,1,1,3,3,3-hexafluoro-2-phenylpropan-2-yl)oxyphosphonium bromide IUPAC Name: tris(diethylamino)-(1,1,1,3,3,3-hexafluoro-2-phenylpropan-2-yl)oxyphosphanium bromide Traditional Name: tris(diethylamino)-[2,2,2-trifluoro-1-phenyl-1-(trifluoromethyl)ethoxy]phosphonium bromide Formula: C21H35BrF6N3OP MolecularWeight: 570.39028

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)[P+](N(CC)CC)(N(CC)CC)OC(C1=CC=CC=C1)(C(F)(F)F)C(F)(F)F.[Br-]

Isomeric SMILES

CCN(CC)[P+](N(CC)CC)(N(CC)CC)OC(C1=CC=CC=C1)(C(F)(F)F)C(F)(F)F.[Br-]

InChI

InChI=1S/C21H35F6N3OP.BrH/c1-7-28(8-2)32(29(9-3)10-4,30(11-5)12-6)31-19(20(22,23)24,21(25,26)27)18-16-14-13-15-17-18;/h13-17H,7-12H2,1-6H3;1H/q+1;/p-1