[4,4-bis(decoxymethyl)-7-(trimethylazaniumyl)heptyl]-trimethyl-azanium diiodide

Systemtic Name: [4,4-bis(decoxymethyl)-7-(trimethylazaniumyl)heptyl]-trimethyl-azanium diiodide Openeye Name: [4,4-bis(decoxymethyl)-7-(trimethylammonio)heptyl]-trimethyl-ammonium diiodide CAS Name: [4,4-bis(decoxymethyl)-7-(trimethylammonio)heptyl]-trimethylammonium diiodide IUPAC Name: [4,4-bis(decoxymethyl)-7-(trimethylazaniumyl)heptyl]-trimethylazanium diiodide Traditional Name: [4,4-bis(decoxymethyl)-7-(trimethylammonio)heptyl]-trimethyl-ammonium diiodide Formula: C35H76I2N2O2 MolecularWeight: 810.79908

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCOCC(CCC[N+](C)(C)C)(CCC[N+](C)(C)C)COCCCCCCCCCC.[I-].[I-]

Isomeric SMILES

CCCCCCCCCCOCC(CCC[N+](C)(C)C)(CCC[N+](C)(C)C)COCCCCCCCCCC.[I-].[I-]

InChI

InChI=1S/C35H76N2O2.2HI/c1-9-11-13-15-17-19-21-23-31-38-33-35(27-25-29-36(3,4)5,28-26-30-37(6,7)8)34-39-32-24-22-20-18-16-14-12-10-2;;/h9-34H2,1-8H3;2*1H/q+2;;/p-2