(3,5-dimethylphenyl) 5-bromanyl-6-chloranyl-pyridine-3-sulfonate

Systemtic Name: (3,5-dimethylphenyl) 5-bromanyl-6-chloranyl-pyridine-3-sulfonate Openeye Name: (3,5-dimethylphenyl) 5-bromo-6-chloro-pyridine-3-sulfonate CAS Name: 5-bromo-6-chloro-3-pyridinesulfonic acid (3,5-dimethylphenyl) ester IUPAC Name: (3,5-dimethylphenyl) 5-bromo-6-chloropyridine-3-sulfonate Traditional Name: 5-bromo-6-chloro-pyridine-3-sulfonic acid (3,5-dimethylphenyl) ester Formula: C13H11BrClNO3S MolecularWeight: 376.65334

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H11BrClNO3S/c1-8-3-9(2)5-10(4-8)19-20(17,18)11-6-12(14)13(15)16-7-11/h3-7H,1-2H3