dimethyl-[[2-[2-methyl-3-(3-methylbut-2-enyl)oxiran-2-yl]-1-oxidanyl-4-oxidanylidene-cyclohexyl]methyl]sulfanium iodide

Systemtic Name: dimethyl-[[2-[2-methyl-3-(3-methylbut-2-enyl)oxiran-2-yl]-1-oxidanyl-4-oxidanylidene-cyclohexyl]methyl]sulfanium iodide Openeye Name: [1-hydroxy-2-[2-methyl-3-(3-methylbut-2-enyl)oxiran-2-yl]-4-oxo-cyclohexyl]methyl-dimethyl-sulfonium iodide CAS Name: [1-hydroxy-2-[2-methyl-3-(3-methylbut-2-enyl)-2-oxiranyl]-4-oxocyclohexyl]methyl-dimethylsulfonium iodide IUPAC Name: [1-hydroxy-2-[2-methyl-3-(3-methylbut-2-enyl)oxiran-2-yl]-4-oxocyclohexyl]methyl-dimethylsulfanium iodide Traditional Name: [1-hydroxy-4-keto-2-[2-methyl-3-(3-methylbut-2-enyl)oxiran-2-yl]cyclohexyl]methyl-dimethyl-sulfonium iodide Formula: C17H29IO3S MolecularWeight: 440.37983

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CCC1C(O1)(C)C2CC(=O)CCC2(C[S+](C)C)O)C.[I-]

Isomeric SMILES

CC(=CCC1C(O1)(C)C2CC(=O)CCC2(C[S+](C)C)O)C.[I-]

InChI

InChI=1S/C17H29O3S.HI/c1-12(2)6-7-15-16(3,20-15)14-10-13(18)8-9-17(14,19)11-21(4)5;/h6,14-15,19H,7-11H2,1-5H3;1H/q+1;/p-1