N-(hydroxymethyl)-N-(thian-1-ium-3-yl)ethanamide iodide

Systemtic Name: N-(hydroxymethyl)-N-(thian-1-ium-3-yl)ethanamide iodide Openeye Name: N-(hydroxymethyl)-N-tetrahydrothiopyran-1-ium-3-yl-acetamide iodide CAS Name: N-(hydroxymethyl)-N-(3-thian-1-iumyl)acetamide iodide IUPAC Name: N-(hydroxymethyl)-N-(thian-1-ium-3-yl)acetamide iodide Traditional Name: N-methylol-N-tetrahydrothiopyran-1-ium-3-yl-acetamide iodide Formula: C8H16INO2S MolecularWeight: 317.18761

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N(CO)C1CCC[SH+]C1.[I-]

Isomeric SMILES

CC(=O)N(CO)C1CCC[SH+]C1.[I-]

InChI

InChI=1S/C8H15NO2S.HI/c1-7(11)9(6-10)8-3-2-4-12-5-8;/h8,10H,2-6H2,1H3;1H