5-ethoxy-3-[(Z)-2-(1-methylpyridin-1-ium-4-yl)ethenyl]-1H-indole iodide

Systemtic Name: 5-ethoxy-3-[(Z)-2-(1-methylpyridin-1-ium-4-yl)ethenyl]-1H-indole iodide Openeye Name: 5-ethoxy-3-[(Z)-2-(1-methylpyridin-1-ium-4-yl)vinyl]-1H-indole iodide CAS Name: 5-ethoxy-3-[(Z)-2-(1-methyl-4-pyridin-1-iumyl)ethenyl]-1H-indole iodide IUPAC Name: 5-ethoxy-3-[(Z)-2-(1-methylpyridin-1-ium-4-yl)ethenyl]-1H-indole iodide Traditional Name: 5-ethoxy-3-[(Z)-2-(1-methylpyridin-1-ium-4-yl)vinyl]-1H-indole iodide Formula: C18H19IN2O MolecularWeight: 406.26073

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)NC=C2C=CC3=CC=[N+](C=C3)C.[I-]

Isomeric SMILES

CCOC1=CC2=C(C=C1)NC=C2/C=C\C3=CC=[N+](C=C3)C.[I-]

InChI

InChI=1S/C18H18N2O.HI/c1-3-21-16-6-7-18-17(12-16)15(13-19-18)5-4-14-8-10-20(2)11-9-14;/h4-13H,3H2,1-2H3;1H