dimethyl-[2-[(2E)-2-(1-methylimidazolidin-2-ylidene)-2-nitro-ethanoyl]oxyethyl]sulfanium iodide

Systemtic Name: dimethyl-[2-[(2E)-2-(1-methylimidazolidin-2-ylidene)-2-nitro-ethanoyl]oxyethyl]sulfanium iodide Openeye Name: dimethyl-[2-[(2E)-2-(1-methylimidazolidin-2-ylidene)-2-nitro-acetyl]oxyethyl]sulfonium iodide CAS Name: dimethyl-[2-[(2E)-2-(1-methyl-2-imidazolidinylidene)-2-nitro-1-oxoethoxy]ethyl]sulfonium iodide IUPAC Name: dimethyl-[2-[(2E)-2-(1-methylimidazolidin-2-ylidene)-2-nitroacetyl]oxyethyl]sulfanium iodide Traditional Name: dimethyl-[2-[(2E)-2-(1-methylimidazolidin-2-ylidene)-2-nitro-acetyl]oxyethyl]sulfonium iodide Formula: C10H18IN3O4S MolecularWeight: 403.23709

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCNC1=C(C(=O)OCC[S+](C)C)[N+](=O)[O-].[I-]

Isomeric SMILES

CN\1CCN/C1=C(/C(=O)OCC[S+](C)C)\[N+](=O)[O-].[I-]

InChI

InChI=1S/C10H17N3O4S.HI/c1-12-5-4-11-9(12)8(13(15)16)10(14)17-6-7-18(2)3;/h4-7H2,1-3H3;1H