1-ethyl-2,5-dimethyl-3-[(E)-2-(1-methylpyridin-1-ium-4-yl)ethenyl]indole iodide

Systemtic Name: 1-ethyl-2,5-dimethyl-3-[(E)-2-(1-methylpyridin-1-ium-4-yl)ethenyl]indole iodide Openeye Name: 1-ethyl-2,5-dimethyl-3-[(E)-2-(1-methylpyridin-1-ium-4-yl)vinyl]indole iodide CAS Name: 1-ethyl-2,5-dimethyl-3-[(E)-2-(1-methyl-4-pyridin-1-iumyl)ethenyl]indole iodide IUPAC Name: 1-ethyl-2,5-dimethyl-3-[(E)-2-(1-methylpyridin-1-ium-4-yl)ethenyl]indole iodide Traditional Name: 1-ethyl-2,5-dimethyl-3-[(E)-2-(1-methylpyridin-1-ium-4-yl)vinyl]indole iodide Formula: C20H23IN2 MolecularWeight: 418.31449

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H23N2.HI/c1-5-22-16(3)18(19-14-15(2)6-9-20(19)22)8-7-17-10-12-21(4)13-11-17;/h6-14H,5H2,1-4H3;1H/q+1;/p-1