3-methyl-2-oxidanyl-4-oxidanylidene-1H-quinoline-6-sulfonic acid

Systemtic Name: 3-methyl-2-oxidanyl-4-oxidanylidene-1H-quinoline-6-sulfonic acid Openeye Name: 2-hydroxy-3-methyl-4-oxo-1H-quinoline-6-sulfonic acid CAS Name: 2-hydroxy-3-methyl-4-oxo-1H-quinoline-6-sulfonic acid IUPAC Name: 2-hydroxy-3-methyl-4-oxo-1H-quinoline-6-sulfonic acid Traditional Name: 2-hydroxy-4-keto-3-methyl-1H-quinoline-6-sulfonic acid Formula: C10H9NO5S MolecularWeight: 255.24716

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC2=C(C1=O)C=C(C=C2)S(=O)(=O)O)O

Isomeric SMILES

CC1=C(NC2=C(C1=O)C=C(C=C2)S(=O)(=O)O)O

InChI

InChI=1S/C10H9NO5S/c1-5-9(12)7-4-6(17(14,15)16)2-3-8(7)11-10(5)13/h2-4H,1H3,(H2,11,12,13)(H,14,15,16)