2-methyl-8-oxidanyl-quinoline-5-sulfonate; 8-oxidanylquinoline-5-sulfonate

Systemtic Name: 2-methyl-8-oxidanyl-quinoline-5-sulfonate; 8-oxidanylquinoline-5-sulfonate Openeye Name: 8-hydroxy-2-methyl-quinoline-5-sulfonate; 8-hydroxyquinoline-5-sulfonate CAS Name: 8-hydroxy-2-methyl-5-quinolinesulfonate; 8-hydroxy-5-quinolinesulfonate IUPAC Name: 8-hydroxy-2-methylquinoline-5-sulfonate; 8-hydroxyquinoline-5-sulfonate Traditional Name: 8-hydroxy-2-methyl-quinoline-5-sulfonate; 8-hydroxyquinoline-5-sulfonate Formula: C19H14N2O8S2-2 MolecularWeight: 462.45306

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=CC(=C2C=C1)S(=O)(=O)[O-])O.C1=CC2=C(C=CC(=C2N=C1)O)S(=O)(=O)[O-]

Isomeric SMILES

CC1=NC2=C(C=CC(=C2C=C1)S(=O)(=O)[O-])O.C1=CC2=C(C=CC(=C2N=C1)O)S(=O)(=O)[O-]

InChI

InChI=1S/C10H9NO4S.C9H7NO4S/c1-6-2-3-7-9(16(13,14)15)5-4-8(12)10(7)11-6;11-7-3-4-8(15(12,13)14)6-2-1-5-10-9(6)7/h2-5,12H,1H3,(H,13,14,15);1-5,11H,(H,12,13,14)/p-2