tetrakis[4-(trifluoromethyl)phenyl]boranuide; tributylazanium

Systemtic Name: tetrakis[4-(trifluoromethyl)phenyl]boranuide; tributylazanium Openeye Name: tetrakis[4-(trifluoromethyl)phenyl]boranuide; tributylammonium CAS Name: tetrakis[4-(trifluoromethyl)phenyl]boranuide; tributylammonium IUPAC Name: tetrakis[4-(trifluoromethyl)phenyl]boranuide; tributylazanium Traditional Name: tetrakis[4-(trifluoromethyl)phenyl]boranuide; tributylammonium Formula: C40H44BF12N MolecularWeight: 777.575898

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Descriptors Computed from Structure

Canonical SMILES:

[B-](C1=CC=C(C=C1)C(F)(F)F)(C2=CC=C(C=C2)C(F)(F)F)(C3=CC=C(C=C3)C(F)(F)F)C4=CC=C(C=C4)C(F)(F)F.CCCC[NH+](CCCC)CCCC

Isomeric SMILES

[B-](C1=CC=C(C=C1)C(F)(F)F)(C2=CC=C(C=C2)C(F)(F)F)(C3=CC=C(C=C3)C(F)(F)F)C4=CC=C(C=C4)C(F)(F)F.CCCC[NH+](CCCC)CCCC

InChI

InChI=1S/C28H16BF12.C12H27N/c30-25(31,32)17-1-9-21(10-2-17)29(22-11-3-18(4-12-22)26(33,34)35,23-13-5-19(6-14-23)27(36,37)38)24-15-7-20(8-16-24)28(39,40)41;1-4-7-10-13(11-8-5-2)12-9-6-3/h1-16H;4-12H2,1-3H3/q-1;/p+1