(2R,3S,4S)-2-(hydroxymethyl)-1-methyl-thiolan-1-ium-3,4-diol iodide

Systemtic Name: (2R,3S,4S)-2-(hydroxymethyl)-1-methyl-thiolan-1-ium-3,4-diol iodide Openeye Name: (2R,3S,4S)-2-(hydroxymethyl)-1-methyl-tetrahydrothiophen-1-ium-3,4-diol iodide CAS Name: (2R,3S,4S)-2-(hydroxymethyl)-1-methylthiolan-1-ium-3,4-diol iodide IUPAC Name: (2R,3S,4S)-2-(hydroxymethyl)-1-methylthiolan-1-ium-3,4-diol iodide Traditional Name: (2R,3S,4S)-1-methyl-2-methylol-tetrahydrothiophen-1-ium-3,4-diol iodide Formula: C6H13IO3S MolecularWeight: 292.13509

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Descriptors Computed from Structure

Canonical SMILES:

C[S+]1CC(C(C1CO)O)O.[I-]

Isomeric SMILES

C[S+]1C[C@H]([C@@H]([C@H]1CO)O)O.[I-]

InChI

InChI=1S/C6H13O3S.HI/c1-10-3-4(8)6(9)5(10)2-7;/h4-9H,2-3H2,1H3;1H/q+1;/p-1/t4-,5-,6+,10?;/m1./s1