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

Systemtic Name: 1-methyl-2-(2-propyl-1,3-dioxan-5-yl)pyridin-1-ium iodide Openeye Name: 1-methyl-2-(2-propyl-1,3-dioxan-5-yl)pyridin-1-ium iodide CAS Name: 1-methyl-2-(2-propyl-1,3-dioxan-5-yl)pyridin-1-ium iodide IUPAC Name: 1-methyl-2-(2-propyl-1,3-dioxan-5-yl)pyridin-1-ium iodide Traditional Name: 1-methyl-2-(2-propyl-1,3-dioxan-5-yl)pyridin-1-ium iodide Formula: C13H20INO2 MolecularWeight: 349.20787

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1OCC(CO1)C2=CC=CC=[N+]2C.[I-]

Isomeric SMILES

CCCC1OCC(CO1)C2=CC=CC=[N+]2C.[I-]

InChI

InChI=1S/C13H20NO2.HI/c1-3-6-13-15-9-11(10-16-13)12-7-4-5-8-14(12)2;/h4-5,7-8,11,13H,3,6,9-10H2,1-2H3;1H/q+1;/p-1