1-ethyl-3-methyl-imidazol-3-ium; 4-methylbenzenesulfinate

Systemtic Name: 1-ethyl-3-methyl-imidazol-3-ium; 4-methylbenzenesulfinate Openeye Name: 1-ethyl-3-methyl-imidazol-3-ium; 4-methylbenzenesulfinate CAS Name: 1-ethyl-3-methylimidazol-3-ium; 4-methylbenzenesulfinate IUPAC Name: 1-ethyl-3-methylimidazol-3-ium; 4-methylbenzenesulfinate Traditional Name: 1-ethyl-3-methyl-imidazol-3-ium; 4-methylbenzenesulfinate Formula: C13H18N2O2S MolecularWeight: 266.35922

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C[N+](=C1)C.CC1=CC=C(C=C1)S(=O)[O-]

Isomeric SMILES

CCN1C=C[N+](=C1)C.CC1=CC=C(C=C1)S(=O)[O-]

InChI

InChI=1S/C7H8O2S.C6H11N2/c1-6-2-4-7(5-3-6)10(8)9;1-3-8-5-4-7(2)6-8/h2-5H,1H3,(H,8,9);4-6H,3H2,1-2H3/q;+1/p-1