dihexyl-[2,4,5-tris(fluoranyl)-3-(trifluoromethyl)phenyl]azanium; tetrakis[8-ethyl-2,3,4,5,6,7-hexakis(fluoranyl)naphthalen-1-yl]alumanuide

Systemtic Name: dihexyl-[2,4,5-tris(fluoranyl)-3-(trifluoromethyl)phenyl]azanium; tetrakis[8-ethyl-2,3,4,5,6,7-hexakis(fluoranyl)naphthalen-1-yl]alumanuide Openeye Name: dihexyl-[2,4,5-trifluoro-3-(trifluoromethyl)phenyl]ammonium; tetrakis(8-ethyl-2,3,4,5,6,7-hexafluoro-1-naphthyl)alumanuide CAS Name: dihexyl-[2,4,5-trifluoro-3-(trifluoromethyl)phenyl]ammonium; tetrakis(8-ethyl-2,3,4,5,6,7-hexafluoro-1-naphthalenyl)alumanuide IUPAC Name: dihexyl-[2,4,5-trifluoro-3-(trifluoromethyl)phenyl]azanium; tetrakis(8-ethyl-2,3,4,5,6,7-hexafluoronaphthalen-1-yl)alumanuide Traditional Name: dihexyl-[2,4,5-trifluoro-3-(trifluoromethyl)phenyl]ammonium; tetrakis(8-ethyl-2,3,4,5,6,7-hexafluoro-1-naphthyl)alumanuide Formula: C67H48AlF30N MolecularWeight: 1464.038354

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC[NH+](CCCCCC)C1=CC(=C(C(=C1F)C(F)(F)F)F)F.CCC1=C(C(=C(C2=C1C(=C(C(=C2F)F)F)[Al-](C3=C(C(=C(C4=C3C(=C(C(=C4F)F)F)CC)F)F)F)(C5=C(C(=C(C6=C5C(=C(C(=C6F)F)F)CC)F)F)F)C7=C(C(=C(C8=C7C(=C(C(=C8F)F)F)CC)F)F)F)F)F)F

Isomeric SMILES

CCCCCC[NH+](CCCCCC)C1=CC(=C(C(=C1F)C(F)(F)F)F)F.CCC1=C(C(=C(C2=C1C(=C(C(=C2F)F)F)[Al-](C3=C(C(=C(C4=C3C(=C(C(=C4F)F)F)CC)F)F)F)(C5=C(C(=C(C6=C5C(=C(C(=C6F)F)F)CC)F)F)F)C7=C(C(=C(C8=C7C(=C(C(=C8F)F)F)CC)F)F)F)F)F)F

InChI

InChI=1S/C19H27F6N.4C12H5F6.Al/c1-3-5-7-9-11-26(12-10-8-6-4-2)15-13-14(20)17(21)16(18(15)22)19(23,24)25;4*1-2-4-5-3-6(13)9(15)10(16)7(5)11(17)12(18)8(4)14;/h13H,3-12H2,1-2H3;4*2H2,1H3;/q;;;;;-1/p+1