3-(4-methylphenyl)propyl 2-(4-methylmorpholin-4-ium-4-yl)ethanoate iodide

Systemtic Name: 3-(4-methylphenyl)propyl 2-(4-methylmorpholin-4-ium-4-yl)ethanoate iodide Openeye Name: 3-(p-tolyl)propyl 2-(4-methylmorpholin-4-ium-4-yl)acetate iodide CAS Name: 2-(4-methyl-4-morpholin-4-iumyl)acetic acid 3-(4-methylphenyl)propyl ester iodide IUPAC Name: 3-(4-methylphenyl)propyl 2-(4-methylmorpholin-4-ium-4-yl)acetate iodide Traditional Name: 2-(4-methylmorpholin-4-ium-4-yl)acetic acid 3-(p-tolyl)propyl ester iodide Formula: C17H26INO3 MolecularWeight: 419.29771

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CCCOC(=O)C[N+]2(CCOCC2)C.[I-]

Isomeric SMILES

CC1=CC=C(C=C1)CCCOC(=O)C[N+]2(CCOCC2)C.[I-]

InChI

InChI=1S/C17H26NO3.HI/c1-15-5-7-16(8-6-15)4-3-11-21-17(19)14-18(2)9-12-20-13-10-18;/h5-8H,3-4,9-14H2,1-2H3;1H/q+1;/p-1