2,6-dimethylpyridine-4-sulfonic acid

Systemtic Name: 2,6-dimethylpyridine-4-sulfonic acid Openeye Name: 2,6-dimethylpyridine-4-sulfonic acid CAS Name: 2,6-dimethyl-4-pyridinesulfonic acid IUPAC Name: 2,6-dimethylpyridine-4-sulfonic acid Traditional Name: 2,6-dimethylpyridine-4-sulfonic acid Formula: C7H9NO3S MolecularWeight: 187.21626

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=N1)C)S(=O)(=O)O

Isomeric SMILES

CC1=CC(=CC(=N1)C)S(=O)(=O)O

InChI

InChI=1S/C7H9NO3S/c1-5-3-7(12(9,10)11)4-6(2)8-5/h3-4H,1-2H3,(H,9,10,11)