4-methylbenzenesulfonate; methyl-tris(2-methylpropyl)phosphanium

Systemtic Name: 4-methylbenzenesulfonate; methyl-tris(2-methylpropyl)phosphanium Openeye Name: 4-methylbenzenesulfonate; triisobutyl(methyl)phosphonium CAS Name: 4-methylbenzenesulfonate; methyl-tris(2-methylpropyl)phosphonium IUPAC Name: 4-methylbenzenesulfonate; methyl-tris(2-methylpropyl)phosphanium Traditional Name: triisobutyl(methyl)phosphonium tosylate Formula: C20H37O3PS MolecularWeight: 388.544741

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H30P.C7H8O3S/c1-11(2)8-14(7,9-12(3)4)10-13(5)6;1-6-2-4-7(5-3-6)11(8,9)10/h11-13H,8-10H2,1-7H3;2-5H,1H3,(H,8,9,10)/q+1;/p-1