2-(3-methylimidazol-3-ium-1-yl)ethanoic acid chloride

Systemtic Name: 2-(3-methylimidazol-3-ium-1-yl)ethanoic acid chloride Openeye Name: 2-(3-methylimidazol-3-ium-1-yl)acetic acid chloride CAS Name: 2-(3-methyl-1-imidazol-3-iumyl)acetic acid chloride IUPAC Name: 2-(3-methylimidazol-3-ium-1-yl)acetic acid chloride Traditional Name: 2-(3-methylimidazol-3-ium-1-yl)acetic acid chloride Formula: C6H9ClN2O2 MolecularWeight: 176.60086

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=CN(C=C1)CC(=O)O.[Cl-]

Isomeric SMILES

C[N+]1=CN(C=C1)CC(=O)O.[Cl-]

InChI

InChI=1S/C6H8N2O2.ClH/c1-7-2-3-8(5-7)4-6(9)10;/h2-3,5H,4H2,1H3;1H