(3,5-dimethylphenyl) 6-chloranylpyridine-3-sulfonate

Systemtic Name: (3,5-dimethylphenyl) 6-chloranylpyridine-3-sulfonate Openeye Name: (3,5-dimethylphenyl) 6-chloropyridine-3-sulfonate CAS Name: 6-chloro-3-pyridinesulfonic acid (3,5-dimethylphenyl) ester IUPAC Name: (3,5-dimethylphenyl) 6-chloropyridine-3-sulfonate Traditional Name: 6-chloropyridine-3-sulfonic acid (3,5-dimethylphenyl) ester Formula: C13H12ClNO3S MolecularWeight: 297.75728

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)OS(=O)(=O)C2=CN=C(C=C2)Cl)C

Isomeric SMILES

CC1=CC(=CC(=C1)OS(=O)(=O)C2=CN=C(C=C2)Cl)C

InChI

InChI=1S/C13H12ClNO3S/c1-9-5-10(2)7-11(6-9)18-19(16,17)12-3-4-13(14)15-8-12/h3-8H,1-2H3