5-fluoranyl-2-methyl-3-[(E)-2-(1-methylpyridin-1-ium-4-yl)ethenyl]-1H-indole iodide

Systemtic Name: 5-fluoranyl-2-methyl-3-[(E)-2-(1-methylpyridin-1-ium-4-yl)ethenyl]-1H-indole iodide Openeye Name: 5-fluoro-2-methyl-3-[(E)-2-(1-methylpyridin-1-ium-4-yl)vinyl]-1H-indole iodide CAS Name: 5-fluoro-2-methyl-3-[(E)-2-(1-methyl-4-pyridin-1-iumyl)ethenyl]-1H-indole iodide IUPAC Name: 5-fluoro-2-methyl-3-[(E)-2-(1-methylpyridin-1-ium-4-yl)ethenyl]-1H-indole iodide Traditional Name: 5-fluoro-2-methyl-3-[(E)-2-(1-methylpyridin-1-ium-4-yl)vinyl]-1H-indole iodide Formula: C17H16FIN2 MolecularWeight: 394.225213

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(N1)C=CC(=C2)F)C=CC3=CC=[N+](C=C3)C.[I-]

Isomeric SMILES

CC1=C(C2=C(N1)C=CC(=C2)F)/C=C/C3=CC=[N+](C=C3)C.[I-]

InChI

InChI=1S/C17H15FN2.HI/c1-12-15(5-3-13-7-9-20(2)10-8-13)16-11-14(18)4-6-17(16)19-12;/h3-11H,1-2H3;1H