dodecyl-ethyl-[3-(2-ethylhexoxy)-3-oxidanylidene-propyl]sulfanium; 4-methylbenzenesulfonate

Systemtic Name: dodecyl-ethyl-[3-(2-ethylhexoxy)-3-oxidanylidene-propyl]sulfanium; 4-methylbenzenesulfonate Openeye Name: dodecyl-ethyl-[3-(2-ethylhexoxy)-3-oxo-propyl]sulfonium; 4-methylbenzenesulfonate CAS Name: dodecyl-ethyl-[3-(2-ethylhexoxy)-3-oxopropyl]sulfonium; 4-methylbenzenesulfonate IUPAC Name: dodecyl-ethyl-[3-(2-ethylhexoxy)-3-oxopropyl]sulfanium; 4-methylbenzenesulfonate Traditional Name: ethyl-[3-(2-ethylhexoxy)-3-keto-propyl]-lauryl-sulfonium tosylate Formula: C32H58O5S2 MolecularWeight: 586.92992

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC[S+](CC)CCC(=O)OCC(CC)CCCC.CC1=CC=C(C=C1)S(=O)(=O)[O-]

Isomeric SMILES

CCCCCCCCCCCC[S+](CC)CCC(=O)OCC(CC)CCCC.CC1=CC=C(C=C1)S(=O)(=O)[O-]

InChI

InChI=1S/C25H51O2S.C7H8O3S/c1-5-9-11-12-13-14-15-16-17-18-21-28(8-4)22-20-25(26)27-23-24(7-3)19-10-6-2;1-6-2-4-7(5-3-6)11(8,9)10/h24H,5-23H2,1-4H3;2-5H,1H3,(H,8,9,10)/q+1;/p-1