dibutyl(2-oxidanylidenepropyl)sulfanium; 4-methylbenzenesulfonate

Systemtic Name: dibutyl(2-oxidanylidenepropyl)sulfanium; 4-methylbenzenesulfonate Openeye Name: acetonyl(dibutyl)sulfonium; 4-methylbenzenesulfonate CAS Name: dibutyl(2-oxopropyl)sulfonium; 4-methylbenzenesulfonate IUPAC Name: dibutyl(2-oxopropyl)sulfanium; 4-methylbenzenesulfonate Traditional Name: acetonyl(dibutyl)sulfonium tosylate Formula: C18H30O4S2 MolecularWeight: 374.5584

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H23OS.C7H8O3S/c1-4-6-8-13(9-7-5-2)10-11(3)12;1-6-2-4-7(5-3-6)11(8,9)10/h4-10H2,1-3H3;2-5H,1H3,(H,8,9,10)/q+1;/p-1