2-(2-methyl-1,3-dihydroisoindol-2-ium-2-yl)ethyl-pentan-3-yl-azanium diiodide

Systemtic Name: 2-(2-methyl-1,3-dihydroisoindol-2-ium-2-yl)ethyl-pentan-3-yl-azanium diiodide Openeye Name: 1-ethylpropyl-[2-(2-methylisoindolin-2-ium-2-yl)ethyl]ammonium diiodide CAS Name: 2-(2-methyl-1,3-dihydroisoindol-2-ium-2-yl)ethyl-pentan-3-ylammonium diiodide IUPAC Name: 2-(2-methyl-1,3-dihydroisoindol-2-ium-2-yl)ethyl-pentan-3-ylazanium diiodide Traditional Name: 1-ethylpropyl-[2-(2-methylisoindolin-2-ium-2-yl)ethyl]ammonium diiodide Formula: C16H28I2N2 MolecularWeight: 502.21586

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)[NH2+]CC[N+]1(CC2=CC=CC=C2C1)C.[I-].[I-]

Isomeric SMILES

CCC(CC)[NH2+]CC[N+]1(CC2=CC=CC=C2C1)C.[I-].[I-]

InChI

InChI=1S/C16H27N2.2HI/c1-4-16(5-2)17-10-11-18(3)12-14-8-6-7-9-15(14)13-18;;/h6-9,16-17H,4-5,10-13H2,1-3H3;2*1H/q+1;;/p-1