(NE)-N-[(3-methyl-2-methylsulfanyl-1-prop-2-enyl-imidazol-1-ium-4-yl)methylidene]hydroxylamine iodide

Systemtic Name: (NE)-N-[(3-methyl-2-methylsulfanyl-1-prop-2-enyl-imidazol-1-ium-4-yl)methylidene]hydroxylamine iodide Openeye Name: (4E)-1-allyl-3-methyl-2-methylsulfanyl-imidazol-1-ium-4-carbaldehyde oxime iodide CAS Name: (4E)-3-methyl-2-(methylthio)-1-prop-2-enyl-4-imidazol-1-iumcarboxaldehyde oxime iodide IUPAC Name: (NE)-N-[(3-methyl-2-methylsulfanyl-1-prop-2-enylimidazol-1-ium-4-yl)methylidene]hydroxylamine iodide Traditional Name: (4E)-1-allyl-3-methyl-2-(methylthio)imidazol-1-ium-4-carbaldehyde oxime iodide Formula: C9H14IN3OS MolecularWeight: 339.19643

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C[N+](=C1SC)CC=C)C=NO.[I-]

Isomeric SMILES

CN1C(=C[N+](=C1SC)CC=C)/C=N/O.[I-]

InChI

InChI=1S/C9H13N3OS.HI/c1-4-5-12-7-8(6-10-13)11(2)9(12)14-3;/h4,6-7H,1,5H2,2-3H3;1H/b10-6+;