4-methylbenzenesulfonate; 3-methyl-1H-imidazol-3-ium

Systemtic Name: 4-methylbenzenesulfonate; 3-methyl-1H-imidazol-3-ium Openeye Name: 4-methylbenzenesulfonate; 3-methyl-1H-imidazol-3-ium CAS Name: 4-methylbenzenesulfonate; 3-methyl-1H-imidazol-3-ium IUPAC Name: 4-methylbenzenesulfonate; 3-methyl-1H-imidazol-3-ium Traditional Name: 3-methyl-1H-imidazol-3-ium tosylate Formula: C11H14N2O3S MolecularWeight: 254.30546

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)[O-].C[N+]1=CNC=C1

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)[O-].C[N+]1=CNC=C1

InChI

InChI=1S/C7H8O3S.C4H6N2/c1-6-2-4-7(5-3-6)11(8,9)10;1-6-3-2-5-4-6/h2-5H,1H3,(H,8,9,10);2-4H,1H3