[2-[3,4-bis(oxidanyl)phenyl]-2-oxidanylidene-ethyl]-dimethyl-sulfanium iodide

Systemtic Name: [2-[3,4-bis(oxidanyl)phenyl]-2-oxidanylidene-ethyl]-dimethyl-sulfanium iodide Openeye Name: [2-(3,4-dihydroxyphenyl)-2-oxo-ethyl]-dimethyl-sulfonium iodide CAS Name: [2-(3,4-dihydroxyphenyl)-2-oxoethyl]-dimethylsulfonium iodide IUPAC Name: [2-(3,4-dihydroxyphenyl)-2-oxoethyl]-dimethylsulfanium iodide Traditional Name: [2-(3,4-dihydroxyphenyl)-2-keto-ethyl]-dimethyl-sulfonium iodide Formula: C10H13IO3S MolecularWeight: 340.17789

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H12O3S.HI/c1-14(2)6-10(13)7-3-4-8(11)9(12)5-7;/h3-5H,6H2,1-2H3,(H-,11,12,13);1H