1-[4-(3-methylbutoxy)phenyl]-2-(4-methylmorpholin-4-ium-4-yl)ethanone iodide

Systemtic Name: 1-[4-(3-methylbutoxy)phenyl]-2-(4-methylmorpholin-4-ium-4-yl)ethanone iodide Openeye Name: 1-(4-isopentyloxyphenyl)-2-(4-methylmorpholin-4-ium-4-yl)ethanone iodide CAS Name: 1-[4-(3-methylbutoxy)phenyl]-2-(4-methyl-4-morpholin-4-iumyl)ethanone iodide IUPAC Name: 1-[4-(3-methylbutoxy)phenyl]-2-(4-methylmorpholin-4-ium-4-yl)ethanone iodide Traditional Name: 1-(4-isoamoxyphenyl)-2-(4-methylmorpholin-4-ium-4-yl)ethanone iodide Formula: C18H28INO3 MolecularWeight: 433.32429

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCOC1=CC=C(C=C1)C(=O)C[N+]2(CCOCC2)C.[I-]

Isomeric SMILES

CC(C)CCOC1=CC=C(C=C1)C(=O)C[N+]2(CCOCC2)C.[I-]

InChI

InChI=1S/C18H28NO3.HI/c1-15(2)8-11-22-17-6-4-16(5-7-17)18(20)14-19(3)9-12-21-13-10-19;/h4-7,15H,8-14H2,1-3H3;1H/q+1;/p-1