2-[2-(1-methylpiperidin-1-ium-1-yl)ethanoyloxy]ethyl-pentan-3-yl-azanium diiodide

Systemtic Name: 2-[2-(1-methylpiperidin-1-ium-1-yl)ethanoyloxy]ethyl-pentan-3-yl-azanium diiodide Openeye Name: 1-ethylpropyl-[2-[2-(1-methylpiperidin-1-ium-1-yl)acetyl]oxyethyl]ammonium diiodide CAS Name: 2-[2-(1-methyl-1-piperidin-1-iumyl)-1-oxoethoxy]ethyl-pentan-3-ylammonium diiodide IUPAC Name: 2-[2-(1-methylpiperidin-1-ium-1-yl)acetyl]oxyethyl-pentan-3-ylazanium diiodide Traditional Name: 1-ethylpropyl-[2-[2-(1-methylpiperidin-1-ium-1-yl)acetyl]oxyethyl]ammonium diiodide Formula: C15H32I2N2O2 MolecularWeight: 526.23572

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)[NH2+]CCOC(=O)C[N+]1(CCCCC1)C.[I-].[I-]

Isomeric SMILES

CCC(CC)[NH2+]CCOC(=O)C[N+]1(CCCCC1)C.[I-].[I-]

InChI

InChI=1S/C15H31N2O2.2HI/c1-4-14(5-2)16-9-12-19-15(18)13-17(3)10-7-6-8-11-17;;/h14,16H,4-13H2,1-3H3;2*1H/q+1;;/p-1