4-(5,6-dimethoxy-1-benzofuran-2-yl)-1-methyl-pyridin-1-ium iodide

Systemtic Name: 4-(5,6-dimethoxy-1-benzofuran-2-yl)-1-methyl-pyridin-1-ium iodide Openeye Name: 4-(5,6-dimethoxybenzofuran-2-yl)-1-methyl-pyridin-1-ium iodide CAS Name: 4-(5,6-dimethoxy-2-benzofuranyl)-1-methylpyridin-1-ium iodide IUPAC Name: 4-(5,6-dimethoxy-1-benzofuran-2-yl)-1-methylpyridin-1-ium iodide Traditional Name: 4-(5,6-dimethoxybenzofuran-2-yl)-1-methyl-pyridin-1-ium iodide Formula: C16H16INO3 MolecularWeight: 397.20761

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=CC=C(C=C1)C2=CC3=CC(=C(C=C3O2)OC)OC.[I-]

Isomeric SMILES

C[N+]1=CC=C(C=C1)C2=CC3=CC(=C(C=C3O2)OC)OC.[I-]

InChI

InChI=1S/C16H16NO3.HI/c1-17-6-4-11(5-7-17)13-8-12-9-15(18-2)16(19-3)10-14(12)20-13;/h4-10H,1-3H3;1H/q+1;/p-1