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

Systemtic Name: 5-chloranyl-1-ethyl-3-[(E)-2-(1-methylpyridin-1-ium-4-yl)ethenyl]indole iodide Openeye Name: 5-chloro-1-ethyl-3-[(E)-2-(1-methylpyridin-1-ium-4-yl)vinyl]indole iodide CAS Name: 5-chloro-1-ethyl-3-[(E)-2-(1-methyl-4-pyridin-1-iumyl)ethenyl]indole iodide IUPAC Name: 5-chloro-1-ethyl-3-[(E)-2-(1-methylpyridin-1-ium-4-yl)ethenyl]indole iodide Traditional Name: 5-chloro-1-ethyl-3-[(E)-2-(1-methylpyridin-1-ium-4-yl)vinyl]indole iodide Formula: C18H18ClIN2 MolecularWeight: 424.70639

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H18ClN2.HI/c1-3-21-13-15(17-12-16(19)6-7-18(17)21)5-4-14-8-10-20(2)11-9-14;/h4-13H,3H2,1-2H3;1H/q+1;/p-1