3-ethylheptyl-propyl-[2,4,5-tris(fluoranyl)-3-(trifluoromethyl)phenyl]azanium; tetraoctylboranuide

Systemtic Name: 3-ethylheptyl-propyl-[2,4,5-tris(fluoranyl)-3-(trifluoromethyl)phenyl]azanium; tetraoctylboranuide Openeye Name: 3-ethylheptyl-propyl-[2,4,5-trifluoro-3-(trifluoromethyl)phenyl]ammonium; tetraoctylboranuide CAS Name: 3-ethylheptyl-propyl-[2,4,5-trifluoro-3-(trifluoromethyl)phenyl]ammonium; tetraoctylboranuide IUPAC Name: 3-ethylheptyl-propyl-[2,4,5-trifluoro-3-(trifluoromethyl)phenyl]azanium; tetraoctylboranuide Traditional Name: 3-ethylheptyl-propyl-[2,4,5-trifluoro-3-(trifluoromethyl)phenyl]ammonium; tetraoctylboranuide Formula: C51H96BF6N MolecularWeight: 848.116059

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Descriptors Computed from Structure

Canonical SMILES:

[B-](CCCCCCCC)(CCCCCCCC)(CCCCCCCC)CCCCCCCC.CCCCC(CC)CC[NH+](CCC)C1=CC(=C(C(=C1F)C(F)(F)F)F)F

Isomeric SMILES

[B-](CCCCCCCC)(CCCCCCCC)(CCCCCCCC)CCCCCCCC.CCCCC(CC)CC[NH+](CCC)C1=CC(=C(C(=C1F)C(F)(F)F)F)F

InChI

InChI=1S/C32H68B.C19H27F6N/c1-5-9-13-17-21-25-29-33(30-26-22-18-14-10-6-2,31-27-23-19-15-11-7-3)32-28-24-20-16-12-8-4;1-4-7-8-13(6-3)9-11-26(10-5-2)15-12-14(20)17(21)16(18(15)22)19(23,24)25/h5-32H2,1-4H3;12-13H,4-11H2,1-3H3/q-1;/p+1