[2-butoxy-5-[[diethyl(methyl)azaniumyl]methyl]phenyl]methyl-diethyl-methyl-azanium diiodide

Systemtic Name: [2-butoxy-5-[[diethyl(methyl)azaniumyl]methyl]phenyl]methyl-diethyl-methyl-azanium diiodide Openeye Name: [2-butoxy-5-[[diethyl(methyl)ammonio]methyl]phenyl]methyl-diethyl-methyl-ammonium diiodide CAS Name: [2-butoxy-5-[[diethyl(methyl)ammonio]methyl]phenyl]methyl-diethyl-methylammonium diiodide IUPAC Name: [2-butoxy-5-[[diethyl(methyl)azaniumyl]methyl]phenyl]methyl-diethyl-methylazanium diiodide Traditional Name: [2-butoxy-5-[[diethyl(methyl)ammonio]methyl]benzyl]-diethyl-methyl-ammonium diiodide Formula: C22H42I2N2O MolecularWeight: 604.39062

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1)C[N+](C)(CC)CC)C[N+](C)(CC)CC.[I-].[I-]

Isomeric SMILES

CCCCOC1=C(C=C(C=C1)C[N+](C)(CC)CC)C[N+](C)(CC)CC.[I-].[I-]

InChI

InChI=1S/C22H42N2O.2HI/c1-8-13-16-25-22-15-14-20(18-23(6,9-2)10-3)17-21(22)19-24(7,11-4)12-5;;/h14-15,17H,8-13,16,18-19H2,1-7H3;2*1H/q+2;;/p-2