1-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(4-methylmorpholin-4-ium-4-yl)propan-1-one iodide

Systemtic Name: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(4-methylmorpholin-4-ium-4-yl)propan-1-one iodide Openeye Name: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(4-methylmorpholin-4-ium-4-yl)propan-1-one iodide CAS Name: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(4-methyl-4-morpholin-4-iumyl)-1-propanone iodide IUPAC Name: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(4-methylmorpholin-4-ium-4-yl)propan-1-one iodide Traditional Name: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(4-methylmorpholin-4-ium-4-yl)propan-1-one iodide Formula: C16H22INO4 MolecularWeight: 419.25465

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(CCOCC1)CCC(=O)C2=CC3=C(C=C2)OCCO3.[I-]

Isomeric SMILES

C[N+]1(CCOCC1)CCC(=O)C2=CC3=C(C=C2)OCCO3.[I-]

InChI

InChI=1S/C16H22NO4.HI/c1-17(6-8-19-9-7-17)5-4-14(18)13-2-3-15-16(12-13)21-11-10-20-15;/h2-3,12H,4-11H2,1H3;1H/q+1;/p-1