[2-methyl-3-[2-(3,3,5-trimethylcyclohexyl)ethyl]octan-2-yl]azanium iodide

Systemtic Name: [2-methyl-3-[2-(3,3,5-trimethylcyclohexyl)ethyl]octan-2-yl]azanium iodide Openeye Name: [1,1-dimethyl-2-[2-(3,3,5-trimethylcyclohexyl)ethyl]heptyl]ammonium iodide CAS Name: [2-methyl-3-[2-(3,3,5-trimethylcyclohexyl)ethyl]octan-2-yl]ammonium iodide IUPAC Name: [2-methyl-3-[2-(3,3,5-trimethylcyclohexyl)ethyl]octan-2-yl]azanium iodide Traditional Name: [1,1-dimethyl-2-[2-(3,3,5-trimethylcyclohexyl)ethyl]heptyl]ammonium iodide Formula: C20H42IN MolecularWeight: 423.45865

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(CCC1CC(CC(C1)(C)C)C)C(C)(C)[NH3+].[I-]

Isomeric SMILES

CCCCCC(CCC1CC(CC(C1)(C)C)C)C(C)(C)[NH3+].[I-]

InChI

InChI=1S/C20H41N.HI/c1-7-8-9-10-18(20(5,6)21)12-11-17-13-16(2)14-19(3,4)15-17;/h16-18H,7-15,21H2,1-6H3;1H