(3-ethanoylphenyl) 5-chloranyl-1-methyl-imidazole-4-sulfonate

Systemtic Name: (3-ethanoylphenyl) 5-chloranyl-1-methyl-imidazole-4-sulfonate Openeye Name: (3-acetylphenyl) 5-chloro-1-methyl-imidazole-4-sulfonate CAS Name: 5-chloro-1-methyl-4-imidazolesulfonic acid (3-acetylphenyl) ester IUPAC Name: (3-acetylphenyl) 5-chloro-1-methylimidazole-4-sulfonate Traditional Name: 5-chloro-1-methyl-imidazole-4-sulfonic acid (3-acetylphenyl) ester Formula: C12H11ClN2O4S MolecularWeight: 314.74474

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H11ClN2O4S/c1-8(16)9-4-3-5-10(6-9)19-20(17,18)12-11(13)15(2)7-14-12/h3-7H,1-2H3