4-methylpent-4-en-2-yl 2-(1-methylpiperidin-1-ium-1-yl)ethanoate iodide

Systemtic Name: 4-methylpent-4-en-2-yl 2-(1-methylpiperidin-1-ium-1-yl)ethanoate iodide Openeye Name: 1,3-dimethylbut-3-enyl 2-(1-methylpiperidin-1-ium-1-yl)acetate iodide CAS Name: 2-(1-methyl-1-piperidin-1-iumyl)acetic acid 4-methylpent-4-en-2-yl ester iodide IUPAC Name: 4-methylpent-4-en-2-yl 2-(1-methylpiperidin-1-ium-1-yl)acetate iodide Traditional Name: 2-(1-methylpiperidin-1-ium-1-yl)acetic acid 1,3-dimethylbut-3-enyl ester iodide Formula: C14H26INO2 MolecularWeight: 367.26621

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=C)C)OC(=O)C[N+]1(CCCCC1)C.[I-]

Isomeric SMILES

CC(CC(=C)C)OC(=O)C[N+]1(CCCCC1)C.[I-]

InChI

InChI=1S/C14H26NO2.HI/c1-12(2)10-13(3)17-14(16)11-15(4)8-6-5-7-9-15;/h13H,1,5-11H2,2-4H3;1H/q+1;/p-1