4-methyl-2-oxidanyl-6-oxidanylidene-1-propan-2-yl-pyridine-3-sulfonic acid

Systemtic Name: 4-methyl-2-oxidanyl-6-oxidanylidene-1-propan-2-yl-pyridine-3-sulfonic acid Openeye Name: 2-hydroxy-1-isopropyl-4-methyl-6-oxo-pyridine-3-sulfonic acid CAS Name: 2-hydroxy-4-methyl-6-oxo-1-propan-2-yl-3-pyridinesulfonic acid IUPAC Name: 2-hydroxy-4-methyl-6-oxo-1-propan-2-ylpyridine-3-sulfonic acid Traditional Name: 2-hydroxy-1-isopropyl-6-keto-4-methyl-pyridine-3-sulfonic acid Formula: C9H13NO5S MolecularWeight: 247.26822

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)N(C(=C1S(=O)(=O)O)O)C(C)C

Isomeric SMILES

CC1=CC(=O)N(C(=C1S(=O)(=O)O)O)C(C)C

InChI

InChI=1S/C9H13NO5S/c1-5(2)10-7(11)4-6(3)8(9(10)12)16(13,14)15/h4-5,12H,1-3H3,(H,13,14,15)