diethyl-(3-methyl-2-oxidanylidene-butyl)sulfanium; 4-methylbenzenesulfonate

Systemtic Name: diethyl-(3-methyl-2-oxidanylidene-butyl)sulfanium; 4-methylbenzenesulfonate Openeye Name: diethyl-(3-methyl-2-oxo-butyl)sulfonium; 4-methylbenzenesulfonate CAS Name: diethyl-(3-methyl-2-oxobutyl)sulfonium; 4-methylbenzenesulfonate IUPAC Name: diethyl-(3-methyl-2-oxobutyl)sulfanium; 4-methylbenzenesulfonate Traditional Name: diethyl-(2-keto-3-methyl-butyl)sulfonium tosylate Formula: C16H26O4S2 MolecularWeight: 346.50524

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H19OS.C7H8O3S/c1-5-11(6-2)7-9(10)8(3)4;1-6-2-4-7(5-3-6)11(8,9)10/h8H,5-7H2,1-4H3;2-5H,1H3,(H,8,9,10)/q+1;/p-1