cyclohexyl-(2-cyclohexyl-2-oxidanylidene-ethyl)-methyl-sulfanium; 4-methylbenzenesulfonate

Systemtic Name: cyclohexyl-(2-cyclohexyl-2-oxidanylidene-ethyl)-methyl-sulfanium; 4-methylbenzenesulfonate Openeye Name: cyclohexyl-(2-cyclohexyl-2-oxo-ethyl)-methyl-sulfonium; 4-methylbenzenesulfonate CAS Name: cyclohexyl-(2-cyclohexyl-2-oxoethyl)-methylsulfonium; 4-methylbenzenesulfonate IUPAC Name: cyclohexyl-(2-cyclohexyl-2-oxoethyl)-methylsulfanium; 4-methylbenzenesulfonate Traditional Name: cyclohexyl-(2-cyclohexyl-2-keto-ethyl)-methyl-sulfonium tosylate Formula: C22H34O4S2 MolecularWeight: 426.63296

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)[O-].C[S+](CC(=O)C1CCCCC1)C2CCCCC2

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)[O-].C[S+](CC(=O)C1CCCCC1)C2CCCCC2

InChI

InChI=1S/C15H27OS.C7H8O3S/c1-17(14-10-6-3-7-11-14)12-15(16)13-8-4-2-5-9-13;1-6-2-4-7(5-3-6)11(8,9)10/h13-14H,2-12H2,1H3;2-5H,1H3,(H,8,9,10)/q+1;/p-1