2,2,2-tris(chloranyl)ethyl 3-methylimidazol-3-ium-1-sulfonate

Systemtic Name: 2,2,2-tris(chloranyl)ethyl 3-methylimidazol-3-ium-1-sulfonate Openeye Name: 2,2,2-trichloroethyl 3-methylimidazol-3-ium-1-sulfonate CAS Name: 3-methyl-1-imidazol-3-iumsulfonic acid 2,2,2-trichloroethyl ester IUPAC Name: 2,2,2-trichloroethyl 3-methylimidazol-3-ium-1-sulfonate Traditional Name: 3-methylimidazol-3-ium-1-sulfonic acid 2,2,2-trichloroethyl ester Formula: C6H8Cl3N2O3S+ MolecularWeight: 294.56332

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=CN(C=C1)S(=O)(=O)OCC(Cl)(Cl)Cl

Isomeric SMILES

C[N+]1=CN(C=C1)S(=O)(=O)OCC(Cl)(Cl)Cl

InChI

InChI=1S/C6H8Cl3N2O3S/c1-10-2-3-11(5-10)15(12,13)14-4-6(7,8)9/h2-3,5H,4H2,1H3/q+1