2-(7,9-dimethyldecan-2-yl)benzenesulfonate; tetrabutylphosphanium

Systemtic Name: 2-(7,9-dimethyldecan-2-yl)benzenesulfonate; tetrabutylphosphanium Openeye Name: tetrabutylphosphonium; 2-(1,6,8-trimethylnonyl)benzenesulfonate CAS Name: 2-(7,9-dimethyldecan-2-yl)benzenesulfonate; tetrabutylphosphonium IUPAC Name: 2-(7,9-dimethyldecan-2-yl)benzenesulfonate; tetrabutylphosphanium Traditional Name: tetrabutylphosphonium; 2-(1,6,8-trimethylnonyl)besylate Formula: C34H65O3PS MolecularWeight: 584.916861

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC[P+](CCCC)(CCCC)CCCC.CC(C)CC(C)CCCCC(C)C1=CC=CC=C1S(=O)(=O)[O-]

Isomeric SMILES

CCCC[P+](CCCC)(CCCC)CCCC.CC(C)CC(C)CCCCC(C)C1=CC=CC=C1S(=O)(=O)[O-]

InChI

InChI=1S/C18H30O3S.C16H36P/c1-14(2)13-15(3)9-5-6-10-16(4)17-11-7-8-12-18(17)22(19,20)21;1-5-9-13-17(14-10-6-2,15-11-7-3)16-12-8-4/h7-8,11-12,14-16H,5-6,9-10,13H2,1-4H3,(H,19,20,21);5-16H2,1-4H3/q;+1/p-1