sodium 4-(1-oxidanyl-4H-quinolin-4-yl)benzenesulfonate

Systemtic Name: sodium 4-(1-oxidanyl-4H-quinolin-4-yl)benzenesulfonate Openeye Name: sodium 4-(1-hydroxy-4H-quinolin-4-yl)benzenesulfonate CAS Name: sodium 4-(1-hydroxy-4H-quinolin-4-yl)benzenesulfonate IUPAC Name: sodium 4-(1-hydroxy-4H-quinolin-4-yl)benzenesulfonate Traditional Name: sodium 4-(1-hydroxy-4H-quinolin-4-yl)besylate Formula: C15H12NNaO4S MolecularWeight: 325.31485

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(C=CN2O)C3=CC=C(C=C3)S(=O)(=O)[O-].[Na+]

Isomeric SMILES

C1=CC=C2C(=C1)C(C=CN2O)C3=CC=C(C=C3)S(=O)(=O)[O-].[Na+]

InChI

InChI=1S/C15H13NO4S.Na/c17-16-10-9-13(14-3-1-2-4-15(14)16)11-5-7-12(8-6-11)21(18,19)20;/h1-10,13,17H,(H,18,19,20);/q;+1/p-1