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

Systemtic Name: (3,3-dimethyl-2-oxidanylidene-butyl)-diethyl-sulfanium; 4-methylbenzenesulfonate Openeye Name: (3,3-dimethyl-2-oxo-butyl)-diethyl-sulfonium; 4-methylbenzenesulfonate CAS Name: (3,3-dimethyl-2-oxobutyl)-diethylsulfonium; 4-methylbenzenesulfonate IUPAC Name: (3,3-dimethyl-2-oxobutyl)-diethylsulfanium; 4-methylbenzenesulfonate Traditional Name: diethyl-(2-keto-3,3-dimethyl-butyl)sulfonium tosylate Formula: C17H28O4S2 MolecularWeight: 360.53182

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H21OS.C7H8O3S/c1-6-12(7-2)8-9(11)10(3,4)5;1-6-2-4-7(5-3-6)11(8,9)10/h6-8H2,1-5H3;2-5H,1H3,(H,8,9,10)/q+1;/p-1