(3-methylimidazol-3-ium-1-yl)methyl dodecanoate

Systemtic Name: (3-methylimidazol-3-ium-1-yl)methyl dodecanoate Openeye Name: (3-methylimidazol-3-ium-1-yl)methyl dodecanoate CAS Name: dodecanoic acid (3-methyl-1-imidazol-3-iumyl)methyl ester IUPAC Name: (3-methylimidazol-3-ium-1-yl)methyl dodecanoate Traditional Name: lauric acid (3-methylimidazol-3-ium-1-yl)methyl ester Formula: C17H31N2O2+ MolecularWeight: 295.44024

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC(=O)OCN1C=C[N+](=C1)C

Isomeric SMILES

CCCCCCCCCCCC(=O)OCN1C=C[N+](=C1)C

InChI

InChI=1S/C17H31N2O2/c1-3-4-5-6-7-8-9-10-11-12-17(20)21-16-19-14-13-18(2)15-19/h13-15H,3-12,16H2,1-2H3/q+1