1-(2-dodecylmorpholin-4-ium-2-yl)ethanol bromide

Systemtic Name: 1-(2-dodecylmorpholin-4-ium-2-yl)ethanol bromide Openeye Name: 1-(2-dodecylmorpholin-4-ium-2-yl)ethanol bromide CAS Name: 1-(2-dodecyl-2-morpholin-4-iumyl)ethanol bromide IUPAC Name: 1-(2-dodecylmorpholin-4-ium-2-yl)ethanol bromide Traditional Name: 1-(2-laurylmorpholin-4-ium-2-yl)ethanol bromide Formula: C18H38BrNO2 MolecularWeight: 380.40382

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC1(C[NH2+]CCO1)C(C)O.[Br-]

Isomeric SMILES

CCCCCCCCCCCCC1(C[NH2+]CCO1)C(C)O.[Br-]

InChI

InChI=1S/C18H37NO2.BrH/c1-3-4-5-6-7-8-9-10-11-12-13-18(17(2)20)16-19-14-15-21-18;/h17,19-20H,3-16H2,1-2H3;1H