tetrabutylphosphanium; 2,4,6-trimethylbenzenesulfonate

Systemtic Name: tetrabutylphosphanium; 2,4,6-trimethylbenzenesulfonate Openeye Name: tetrabutylphosphonium; 2,4,6-trimethylbenzenesulfonate CAS Name: tetrabutylphosphonium; 2,4,6-trimethylbenzenesulfonate IUPAC Name: tetrabutylphosphanium; 2,4,6-trimethylbenzenesulfonate Traditional Name: tetrabutylphosphonium; 2,4,6-trimethylbesylate Formula: C25H47O3PS MolecularWeight: 458.677641

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[P+](CCCC)(CCCC)CCCC.CC1=CC(=C(C(=C1)C)S(=O)(=O)[O-])C

Isomeric SMILES

CCCC[P+](CCCC)(CCCC)CCCC.CC1=CC(=C(C(=C1)C)S(=O)(=O)[O-])C

InChI

InChI=1S/C16H36P.C9H12O3S/c1-5-9-13-17(14-10-6-2,15-11-7-3)16-12-8-4;1-6-4-7(2)9(8(3)5-6)13(10,11)12/h5-16H2,1-4H3;4-5H,1-3H3,(H,10,11,12)/q+1;/p-1