2-(1-methylindol-3-yl)-5-(1-methylpyridin-1-ium-4-yl)-1,3,4-oxadiazole iodide

Systemtic Name: 2-(1-methylindol-3-yl)-5-(1-methylpyridin-1-ium-4-yl)-1,3,4-oxadiazole iodide Openeye Name: 2-(1-methylindol-3-yl)-5-(1-methylpyridin-1-ium-4-yl)-1,3,4-oxadiazole iodide CAS Name: 2-(1-methyl-3-indolyl)-5-(1-methyl-4-pyridin-1-iumyl)-1,3,4-oxadiazole iodide IUPAC Name: 2-(1-methylindol-3-yl)-5-(1-methylpyridin-1-ium-4-yl)-1,3,4-oxadiazole iodide Traditional Name: 2-(1-methylindol-3-yl)-5-(1-methylpyridin-1-ium-4-yl)-1,3,4-oxadiazole iodide Formula: C17H15IN4O MolecularWeight: 418.23167

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C2=CC=CC=C21)C3=NN=C(O3)C4=CC=[N+](C=C4)C.[I-]

Isomeric SMILES

CN1C=C(C2=CC=CC=C21)C3=NN=C(O3)C4=CC=[N+](C=C4)C.[I-]

InChI

InChI=1S/C17H15N4O.HI/c1-20-9-7-12(8-10-20)16-18-19-17(22-16)14-11-21(2)15-6-4-3-5-13(14)15;/h3-11H,1-2H3;1H/q+1;/p-1