1-ethyl-6-methoxy-3-[(E)-2-(1-methylpyridin-1-ium-4-yl)ethenyl]indole iodide

Systemtic Name: 1-ethyl-6-methoxy-3-[(E)-2-(1-methylpyridin-1-ium-4-yl)ethenyl]indole iodide Openeye Name: 1-ethyl-6-methoxy-3-[(E)-2-(1-methylpyridin-1-ium-4-yl)vinyl]indole iodide CAS Name: 1-ethyl-6-methoxy-3-[(E)-2-(1-methyl-4-pyridin-1-iumyl)ethenyl]indole iodide IUPAC Name: 1-ethyl-6-methoxy-3-[(E)-2-(1-methylpyridin-1-ium-4-yl)ethenyl]indole iodide Traditional Name: 1-ethyl-6-methoxy-3-[(E)-2-(1-methylpyridin-1-ium-4-yl)vinyl]indole iodide Formula: C19H21IN2O MolecularWeight: 420.28731

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C2=C1C=C(C=C2)OC)C=CC3=CC=[N+](C=C3)C.[I-]

Isomeric SMILES

CCN1C=C(C2=C1C=C(C=C2)OC)/C=C/C3=CC=[N+](C=C3)C.[I-]

InChI

InChI=1S/C19H21N2O.HI/c1-4-21-14-16(6-5-15-9-11-20(2)12-10-15)18-8-7-17(22-3)13-19(18)21;/h5-14H,4H2,1-3H3;1H/q+1;/p-1