butyl(trioctyl)phosphanium; (4-methylphenyl)methanesulfonate

Systemtic Name: butyl(trioctyl)phosphanium; (4-methylphenyl)methanesulfonate Openeye Name: butyl(trioctyl)phosphonium; p-tolylmethanesulfonate CAS Name: butyl(trioctyl)phosphonium; (4-methylphenyl)methanesulfonate IUPAC Name: butyl(trioctyl)phosphanium; (4-methylphenyl)methanesulfonate Traditional Name: butyl(trioctyl)phosphonium; p-tolylmethanesulfonate Formula: C36H69O3PS MolecularWeight: 612.970021

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C28H60P.C8H10O3S/c1-5-9-13-16-19-22-26-29(25-12-8-4,27-23-20-17-14-10-6-2)28-24-21-18-15-11-7-3;1-7-2-4-8(5-3-7)6-12(9,10)11/h5-28H2,1-4H3;2-5H,6H2,1H3,(H,9,10,11)/q+1;/p-1