(3-methyl-5-phenyl-pentyl) 2-(1-methylpiperidin-1-ium-1-yl)ethanoate iodide

Systemtic Name: (3-methyl-5-phenyl-pentyl) 2-(1-methylpiperidin-1-ium-1-yl)ethanoate iodide Openeye Name: (3-methyl-5-phenyl-pentyl) 2-(1-methylpiperidin-1-ium-1-yl)acetate iodide CAS Name: 2-(1-methyl-1-piperidin-1-iumyl)acetic acid (3-methyl-5-phenylpentyl) ester iodide IUPAC Name: (3-methyl-5-phenylpentyl) 2-(1-methylpiperidin-1-ium-1-yl)acetate iodide Traditional Name: 2-(1-methylpiperidin-1-ium-1-yl)acetic acid (3-methyl-5-phenyl-pentyl) ester iodide Formula: C20H32INO2 MolecularWeight: 445.37805

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC1=CC=CC=C1)CCOC(=O)C[N+]2(CCCCC2)C.[I-]

Isomeric SMILES

CC(CCC1=CC=CC=C1)CCOC(=O)C[N+]2(CCCCC2)C.[I-]

InChI

InChI=1S/C20H32NO2.HI/c1-18(11-12-19-9-5-3-6-10-19)13-16-23-20(22)17-21(2)14-7-4-8-15-21;/h3,5-6,9-10,18H,4,7-8,11-17H2,1-2H3;1H/q+1;/p-1