(E)-3-(3-methyl-1H-imidazol-3-ium-4-yl)prop-2-enoic acid iodide

Systemtic Name: (E)-3-(3-methyl-1H-imidazol-3-ium-4-yl)prop-2-enoic acid iodide Openeye Name: (E)-3-(3-methyl-1H-imidazol-3-ium-4-yl)prop-2-enoic acid iodide CAS Name: (E)-3-(3-methyl-1H-imidazol-3-ium-4-yl)-2-propenoic acid iodide IUPAC Name: (E)-3-(3-methyl-1H-imidazol-3-ium-4-yl)prop-2-enoic acid iodide Traditional Name: (E)-3-(3-methyl-1H-imidazol-3-ium-4-yl)acrylic acid iodide Formula: C7H9IN2O2 MolecularWeight: 280.06303

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=CNC=C1C=CC(=O)O.[I-]

Isomeric SMILES

C[N+]1=CNC=C1/C=C/C(=O)O.[I-]

InChI

InChI=1S/C7H8N2O2.HI/c1-9-5-8-4-6(9)2-3-7(10)11;/h2-5H,1H3,(H,10,11);1H/b3-2+;