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

Systemtic Name: (3-methylimidazol-3-ium-1-yl)methyl dodecanoate chloride Openeye Name: (3-methylimidazol-3-ium-1-yl)methyl dodecanoate chloride CAS Name: dodecanoic acid (3-methyl-1-imidazol-3-iumyl)methyl ester chloride IUPAC Name: (3-methylimidazol-3-ium-1-yl)methyl dodecanoate chloride Traditional Name: lauric acid (3-methylimidazol-3-ium-1-yl)methyl ester chloride Formula: C17H31ClN2O2 MolecularWeight: 330.89324

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H31N2O2.ClH/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;1H/q+1;/p-1