4-methylheptan-4-yl(4-propylsulfoniobutyl)azanium diiodide

Systemtic Name: 4-methylheptan-4-yl(4-propylsulfoniobutyl)azanium diiodide Openeye Name: (1-methyl-1-propyl-butyl)-(4-propylsulfoniobutyl)ammonium diiodide CAS Name: 4-methylheptan-4-yl(4-propylsulfoniobutyl)ammonium diiodide IUPAC Name: 4-methylheptan-4-yl(4-propylsulfoniobutyl)azanium diiodide Traditional Name: (1-methyl-1-propyl-butyl)-(4-propylsulfoniobutyl)ammonium diiodide Formula: C15H35I2NS MolecularWeight: 515.31904

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)(CCC)[NH2+]CCCC[SH+]CCC.[I-].[I-]

Isomeric SMILES

CCCC(C)(CCC)[NH2+]CCCC[SH+]CCC.[I-].[I-]

InChI

InChI=1S/C15H33NS.2HI/c1-5-10-15(4,11-6-2)16-12-8-9-14-17-13-7-3;;/h16H,5-14H2,1-4H3;2*1H