bis[3,5-bis(trifluoromethyl)phenoxy]borinic acid; dimethyl(phenyl)azanium

Systemtic Name: bis[3,5-bis(trifluoromethyl)phenoxy]borinic acid; dimethyl(phenyl)azanium Openeye Name: bis[3,5-bis(trifluoromethyl)phenoxy]borinic acid; dimethyl(phenyl)ammonium CAS Name: bis[3,5-bis(trifluoromethyl)phenoxy]borinic acid; dimethyl(phenyl)ammonium IUPAC Name: bis[3,5-bis(trifluoromethyl)phenoxy]borinic acid; dimethyl(phenyl)azanium Traditional Name: bis[3,5-bis(trifluoromethyl)phenoxy]borinic acid; dimethyl(phenyl)ammonium Formula: C24H19BF12NO3+ MolecularWeight: 608.204398

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Descriptors Computed from Structure

Canonical SMILES:

B(O)(OC1=CC(=CC(=C1)C(F)(F)F)C(F)(F)F)OC2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F.C[NH+](C)C1=CC=CC=C1

Isomeric SMILES

B(O)(OC1=CC(=CC(=C1)C(F)(F)F)C(F)(F)F)OC2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F.C[NH+](C)C1=CC=CC=C1

InChI

InChI=1S/C16H7BF12O3.C8H11N/c18-13(19,20)7-1-8(14(21,22)23)4-11(3-7)31-17(30)32-12-5-9(15(24,25)26)2-10(6-12)16(27,28)29;1-9(2)8-6-4-3-5-7-8/h1-6,30H;3-7H,1-2H3/p+1