5-methyl-1-(1-methylpiperidin-1-ium-1-yl)hex-4-en-3-one iodide

Systemtic Name: 5-methyl-1-(1-methylpiperidin-1-ium-1-yl)hex-4-en-3-one iodide Openeye Name: 5-methyl-1-(1-methylpiperidin-1-ium-1-yl)hex-4-en-3-one iodide CAS Name: 5-methyl-1-(1-methyl-1-piperidin-1-iumyl)-4-hexen-3-one iodide IUPAC Name: 5-methyl-1-(1-methylpiperidin-1-ium-1-yl)hex-4-en-3-one iodide Traditional Name: 5-methyl-1-(1-methylpiperidin-1-ium-1-yl)hex-4-en-3-one iodide Formula: C13H24INO MolecularWeight: 337.24023

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H24NO.HI/c1-12(2)11-13(15)7-10-14(3)8-5-4-6-9-14;/h11H,4-10H2,1-3H3;1H/q+1;/p-1