1-methyl-2-(2-phenyl-1,3-dioxan-5-yl)pyridin-1-ium iodide

Systemtic Name: 1-methyl-2-(2-phenyl-1,3-dioxan-5-yl)pyridin-1-ium iodide Openeye Name: 1-methyl-2-(2-phenyl-1,3-dioxan-5-yl)pyridin-1-ium iodide CAS Name: 1-methyl-2-(2-phenyl-1,3-dioxan-5-yl)pyridin-1-ium iodide IUPAC Name: 1-methyl-2-(2-phenyl-1,3-dioxan-5-yl)pyridin-1-ium iodide Traditional Name: 1-methyl-2-(2-phenyl-1,3-dioxan-5-yl)pyridin-1-ium iodide Formula: C16H18INO2 MolecularWeight: 383.22409

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=CC=CC=C1C2COC(OC2)C3=CC=CC=C3.[I-]

Isomeric SMILES

C[N+]1=CC=CC=C1C2COC(OC2)C3=CC=CC=C3.[I-]

InChI

InChI=1S/C16H18NO2.HI/c1-17-10-6-5-9-15(17)14-11-18-16(19-12-14)13-7-3-2-4-8-13;/h2-10,14,16H,11-12H2,1H3;1H/q+1;/p-1