2-(4-methylmorpholin-4-ium-4-yl)ethyl adamantane-1-sulfinate iodide

Systemtic Name: 2-(4-methylmorpholin-4-ium-4-yl)ethyl adamantane-1-sulfinate iodide Openeye Name: 2-(4-methylmorpholin-4-ium-4-yl)ethyl adamantane-1-sulfinate iodide CAS Name: 1-adamantanesulfinic acid 2-(4-methyl-4-morpholin-4-iumyl)ethyl ester iodide IUPAC Name: 2-(4-methylmorpholin-4-ium-4-yl)ethyl adamantane-1-sulfinate iodide Traditional Name: adamantane-1-sulfinic acid 2-(4-methylmorpholin-4-ium-4-yl)ethyl ester iodide Formula: C17H30INO3S MolecularWeight: 455.39447

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(CCOCC1)CCOS(=O)C23CC4CC(C2)CC(C4)C3.[I-]

Isomeric SMILES

C[N+]1(CCOCC1)CCOS(=O)C23CC4CC(C2)CC(C4)C3.[I-]

InChI

InChI=1S/C17H30NO3S.HI/c1-18(2-5-20-6-3-18)4-7-21-22(19)17-11-14-8-15(12-17)10-16(9-14)13-17;/h14-16H,2-13H2,1H3;1H/q+1;/p-1