benzene; tetrabutylphosphanium; borate

Systemtic Name: benzene; tetrabutylphosphanium; borate Openeye Name: benzene; tetrabutylphosphonium; borate CAS Name: benzene; tetrabutylphosphonium; borate IUPAC Name: benzene; tetrabutylphosphanium; borate Traditional Name: benzene; tetrabutylphosphonium; borate Formula: C54H114BO3P3 MolecularWeight: 915.213443

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Descriptors Computed from Structure

Canonical SMILES:

B([O-])([O-])[O-].CCCC[P+](CCCC)(CCCC)CCCC.CCCC[P+](CCCC)(CCCC)CCCC.CCCC[P+](CCCC)(CCCC)CCCC.C1=CC=CC=C1

Isomeric SMILES

B([O-])([O-])[O-].CCCC[P+](CCCC)(CCCC)CCCC.CCCC[P+](CCCC)(CCCC)CCCC.CCCC[P+](CCCC)(CCCC)CCCC.C1=CC=CC=C1

InChI

InChI=1S/3C16H36P.C6H6.BO3/c3*1-5-9-13-17(14-10-6-2,15-11-7-3)16-12-8-4;1-2-4-6-5-3-1;2-1(3)4/h3*5-16H2,1-4H3;1-6H;/q3*+1;;-3