quinolin-8-ol; 2-[[4-(1,3-thiazol-2-ylsulfamoyl)phenyl]carbamoyl]benzoic acid

Systemtic Name: quinolin-8-ol; 2-[[4-(1,3-thiazol-2-ylsulfamoyl)phenyl]carbamoyl]benzoic acid Openeye Name: quinolin-8-ol; 2-[[4-(thiazol-2-ylsulfamoyl)phenyl]carbamoyl]benzoic acid CAS Name: 2-[oxo-[4-(2-thiazolylsulfamoyl)anilino]methyl]benzoic acid; 8-quinolinol IUPAC Name: quinolin-8-ol; 2-[[4-(1,3-thiazol-2-ylsulfamoyl)phenyl]carbamoyl]benzoic acid Traditional Name: oxine; 2-[[4-(thiazol-2-ylsulfamoyl)phenyl]carbamoyl]benzoic acid Formula: C26H20N4O6S2 MolecularWeight: 548.5902

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)NC2=CC=C(C=C2)S(=O)(=O)NC3=NC=CS3)C(=O)O.C1=CC2=C(C(=C1)O)N=CC=C2

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)NC2=CC=C(C=C2)S(=O)(=O)NC3=NC=CS3)C(=O)O.C1=CC2=C(C(=C1)O)N=CC=C2

InChI

InChI=1S/C17H13N3O5S2.C9H7NO/c21-15(13-3-1-2-4-14(13)16(22)23)19-11-5-7-12(8-6-11)27(24,25)20-17-18-9-10-26-17;11-8-5-1-3-7-4-2-6-10-9(7)8/h1-10H,(H,18,20)(H,19,21)(H,22,23);1-6,11H