1-(1-benzothiophen-3-yl)-3-(4-methylmorpholin-4-ium-4-yl)propan-1-one iodide

Systemtic Name: 1-(1-benzothiophen-3-yl)-3-(4-methylmorpholin-4-ium-4-yl)propan-1-one iodide Openeye Name: 1-(benzothiophen-3-yl)-3-(4-methylmorpholin-4-ium-4-yl)propan-1-one iodide CAS Name: 1-(1-benzothiophen-3-yl)-3-(4-methyl-4-morpholin-4-iumyl)-1-propanone iodide IUPAC Name: 1-(1-benzothiophen-3-yl)-3-(4-methylmorpholin-4-ium-4-yl)propan-1-one iodide Traditional Name: 1-(benzothiophen-3-yl)-3-(4-methylmorpholin-4-ium-4-yl)propan-1-one iodide Formula: C16H20INO2S MolecularWeight: 417.30497

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(CCOCC1)CCC(=O)C2=CSC3=CC=CC=C32.[I-]

Isomeric SMILES

C[N+]1(CCOCC1)CCC(=O)C2=CSC3=CC=CC=C32.[I-]

InChI

InChI=1S/C16H20NO2S.HI/c1-17(8-10-19-11-9-17)7-6-15(18)14-12-20-16-5-3-2-4-13(14)16;/h2-5,12H,6-11H2,1H3;1H/q+1;/p-1