(4-tert-butylcyclohexyl) 2-(1-methylpyrrolidin-1-ium-1-yl)ethanoate iodide

Systemtic Name: (4-tert-butylcyclohexyl) 2-(1-methylpyrrolidin-1-ium-1-yl)ethanoate iodide Openeye Name: (4-tert-butylcyclohexyl) 2-(1-methylpyrrolidin-1-ium-1-yl)acetate iodide CAS Name: 2-(1-methyl-1-pyrrolidin-1-iumyl)acetic acid (4-tert-butylcyclohexyl) ester iodide IUPAC Name: (4-tert-butylcyclohexyl) 2-(1-methylpyrrolidin-1-ium-1-yl)acetate iodide Traditional Name: 2-(1-methylpyrrolidin-1-ium-1-yl)acetic acid (4-tert-butylcyclohexyl) ester iodide Formula: C17H32INO2 MolecularWeight: 409.34595

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1CCC(CC1)OC(=O)C[N+]2(CCCC2)C.[I-]

Isomeric SMILES

CC(C)(C)C1CCC(CC1)OC(=O)C[N+]2(CCCC2)C.[I-]

InChI

InChI=1S/C17H32NO2.HI/c1-17(2,3)14-7-9-15(10-8-14)20-16(19)13-18(4)11-5-6-12-18;/h14-15H,5-13H2,1-4H3;1H/q+1;/p-1