3-[(E)-2-(1,6-dimethylpyridin-1-ium-2-yl)ethenyl]-5-fluoranyl-1H-indole iodide

Systemtic Name: 3-[(E)-2-(1,6-dimethylpyridin-1-ium-2-yl)ethenyl]-5-fluoranyl-1H-indole iodide Openeye Name: 3-[(E)-2-(1,6-dimethylpyridin-1-ium-2-yl)vinyl]-5-fluoro-1H-indole iodide CAS Name: 3-[(E)-2-(1,6-dimethyl-2-pyridin-1-iumyl)ethenyl]-5-fluoro-1H-indole iodide IUPAC Name: 3-[(E)-2-(1,6-dimethylpyridin-1-ium-2-yl)ethenyl]-5-fluoro-1H-indole iodide Traditional Name: 3-[(E)-2-(1,6-dimethylpyridin-1-ium-2-yl)vinyl]-5-fluoro-1H-indole iodide Formula: C17H16FIN2 MolecularWeight: 394.225213

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=[N+]1C)C=CC2=CNC3=C2C=C(C=C3)F.[I-]

Isomeric SMILES

CC1=CC=CC(=[N+]1C)/C=C/C2=CNC3=C2C=C(C=C3)F.[I-]

InChI

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