[1-(4-methylmorpholin-4-ium-4-yl)-3-phenylmethoxy-propan-2-yl] butanoate iodide

Systemtic Name: [1-(4-methylmorpholin-4-ium-4-yl)-3-phenylmethoxy-propan-2-yl] butanoate iodide Openeye Name: [1-(benzyloxymethyl)-2-(4-methylmorpholin-4-ium-4-yl)ethyl] butanoate iodide CAS Name: butanoic acid [1-(4-methyl-4-morpholin-4-iumyl)-3-phenylmethoxypropan-2-yl] ester iodide IUPAC Name: [1-(4-methylmorpholin-4-ium-4-yl)-3-phenylmethoxypropan-2-yl] butanoate iodide Traditional Name: butyric acid [1-(benzoxymethyl)-2-(4-methylmorpholin-4-ium-4-yl)ethyl] ester iodide Formula: C19H30INO4 MolecularWeight: 463.35027

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)OC(C[N+]1(CCOCC1)C)COCC2=CC=CC=C2.[I-]

Isomeric SMILES

CCCC(=O)OC(C[N+]1(CCOCC1)C)COCC2=CC=CC=C2.[I-]

InChI

InChI=1S/C19H30NO4.HI/c1-3-7-19(21)24-18(14-20(2)10-12-22-13-11-20)16-23-15-17-8-5-4-6-9-17;/h4-6,8-9,18H,3,7,10-16H2,1-2H3;1H/q+1;/p-1