dimethyl-[1-(oxiran-2-yl)tridecan-2-yl]azanium ethanoate

Systemtic Name: dimethyl-[1-(oxiran-2-yl)tridecan-2-yl]azanium ethanoate Openeye Name: dimethyl-[1-(oxiran-2-ylmethyl)dodecyl]ammonium acetate CAS Name: dimethyl-[1-(2-oxiranyl)tridecan-2-yl]ammonium acetate IUPAC Name: dimethyl-[1-(oxiran-2-yl)tridecan-2-yl]azanium acetate Traditional Name: 1-glycidyldodecyl(dimethyl)ammonium acetate Formula: C19H39NO3 MolecularWeight: 329.51786

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC(CC1CO1)[NH+](C)C.CC(=O)[O-]

Isomeric SMILES

CCCCCCCCCCCC(CC1CO1)[NH+](C)C.CC(=O)[O-]

InChI

InChI=1S/C17H35NO.C2H4O2/c1-4-5-6-7-8-9-10-11-12-13-16(18(2)3)14-17-15-19-17;1-2(3)4/h16-17H,4-15H2,1-3H3;1H3,(H,3,4)