diethyl(2-oxidanylidenepentyl)sulfanium; 4-methylbenzenesulfonate

Systemtic Name: diethyl(2-oxidanylidenepentyl)sulfanium; 4-methylbenzenesulfonate Openeye Name: diethyl(2-oxopentyl)sulfonium; 4-methylbenzenesulfonate CAS Name: diethyl(2-oxopentyl)sulfonium; 4-methylbenzenesulfonate IUPAC Name: diethyl(2-oxopentyl)sulfanium; 4-methylbenzenesulfonate Traditional Name: diethyl(2-ketopentyl)sulfonium tosylate Formula: C16H26O4S2 MolecularWeight: 346.50524

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H19OS.C7H8O3S/c1-4-7-9(10)8-11(5-2)6-3;1-6-2-4-7(5-3-6)11(8,9)10/h4-8H2,1-3H3;2-5H,1H3,(H,8,9,10)/q+1;/p-1