(3,5-dimethylphenyl) 5-chloranyl-1-methyl-imidazole-4-sulfonate

Systemtic Name: (3,5-dimethylphenyl) 5-chloranyl-1-methyl-imidazole-4-sulfonate Openeye Name: (3,5-dimethylphenyl) 5-chloro-1-methyl-imidazole-4-sulfonate CAS Name: 5-chloro-1-methyl-4-imidazolesulfonic acid (3,5-dimethylphenyl) ester IUPAC Name: (3,5-dimethylphenyl) 5-chloro-1-methylimidazole-4-sulfonate Traditional Name: 5-chloro-1-methyl-imidazole-4-sulfonic acid (3,5-dimethylphenyl) ester Formula: C12H13ClN2O3S MolecularWeight: 300.76122

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)OS(=O)(=O)C2=C(N(C=N2)C)Cl)C

Isomeric SMILES

CC1=CC(=CC(=C1)OS(=O)(=O)C2=C(N(C=N2)C)Cl)C

InChI

InChI=1S/C12H13ClN2O3S/c1-8-4-9(2)6-10(5-8)18-19(16,17)12-11(13)15(3)7-14-12/h4-7H,1-3H3