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

Systemtic Name: 3-[(E)-2-(1,6-dimethylpyridin-1-ium-2-yl)ethenyl]-2,5-dimethyl-1H-indole iodide Openeye Name: 3-[(E)-2-(1,6-dimethylpyridin-1-ium-2-yl)vinyl]-2,5-dimethyl-1H-indole iodide CAS Name: 3-[(E)-2-(1,6-dimethyl-2-pyridin-1-iumyl)ethenyl]-2,5-dimethyl-1H-indole iodide IUPAC Name: 3-[(E)-2-(1,6-dimethylpyridin-1-ium-2-yl)ethenyl]-2,5-dimethyl-1H-indole iodide Traditional Name: 3-[(E)-2-(1,6-dimethylpyridin-1-ium-2-yl)vinyl]-2,5-dimethyl-1H-indole iodide Formula: C19H21IN2 MolecularWeight: 404.28791

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)NC(=C2C=CC3=[N+](C(=CC=C3)C)C)C.[I-]

Isomeric SMILES

CC1=CC2=C(C=C1)NC(=C2/C=C/C3=[N+](C(=CC=C3)C)C)C.[I-]

InChI

InChI=1S/C19H20N2.HI/c1-13-8-11-19-18(12-13)17(15(3)20-19)10-9-16-7-5-6-14(2)21(16)4;/h5-12H,1-4H3;1H