4-benzo[e][1]benzofuran-2-yl-1-methyl-pyridin-1-ium iodide

Systemtic Name: 4-benzo[e][1]benzofuran-2-yl-1-methyl-pyridin-1-ium iodide Openeye Name: 4-benzo[e]benzofuran-2-yl-1-methyl-pyridin-1-ium iodide CAS Name: 4-(2-benzo[e]benzofuranyl)-1-methylpyridin-1-ium iodide IUPAC Name: 4-benzo[e][1]benzofuran-2-yl-1-methylpyridin-1-ium iodide Traditional Name: 4-benzo[e]benzofuran-2-yl-1-methyl-pyridin-1-ium iodide Formula: C18H14INO MolecularWeight: 387.21433

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=CC=C(C=C1)C2=CC3=C(O2)C=CC4=CC=CC=C43.[I-]

Isomeric SMILES

C[N+]1=CC=C(C=C1)C2=CC3=C(O2)C=CC4=CC=CC=C43.[I-]

InChI

InChI=1S/C18H14NO.HI/c1-19-10-8-14(9-11-19)18-12-16-15-5-3-2-4-13(15)6-7-17(16)20-18;/h2-12H,1H3;1H/q+1;/p-1