diethyl-[2-(2-methyl-1,3-dihydroisoindol-2-ium-2-yl)ethyl]azanium diiodide

Systemtic Name: diethyl-[2-(2-methyl-1,3-dihydroisoindol-2-ium-2-yl)ethyl]azanium diiodide Openeye Name: diethyl-[2-(2-methylisoindolin-2-ium-2-yl)ethyl]ammonium diiodide CAS Name: diethyl-[2-(2-methyl-1,3-dihydroisoindol-2-ium-2-yl)ethyl]ammonium diiodide IUPAC Name: diethyl-[2-(2-methyl-1,3-dihydroisoindol-2-ium-2-yl)ethyl]azanium diiodide Traditional Name: diethyl-[2-(2-methylisoindolin-2-ium-2-yl)ethyl]ammonium diiodide Formula: C15H26I2N2 MolecularWeight: 488.18928

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H25N2.2HI/c1-4-16(5-2)10-11-17(3)12-14-8-6-7-9-15(14)13-17;;/h6-9H,4-5,10-13H2,1-3H3;2*1H/q+1;;/p-1