8-oxidanyl-7-[[2-oxidanyl-2-(4-phenylphenyl)ethanoyl]amino]quinoline-5-sulfonic acid

Systemtic Name: 8-oxidanyl-7-[[2-oxidanyl-2-(4-phenylphenyl)ethanoyl]amino]quinoline-5-sulfonic acid Openeye Name: 8-hydroxy-7-[[2-hydroxy-2-(4-phenylphenyl)acetyl]amino]quinoline-5-sulfonic acid CAS Name: 8-hydroxy-7-[[2-hydroxy-1-oxo-2-(4-phenylphenyl)ethyl]amino]-5-quinolinesulfonic acid IUPAC Name: 8-hydroxy-7-[[2-hydroxy-2-(4-phenylphenyl)acetyl]amino]quinoline-5-sulfonic acid Traditional Name: 8-hydroxy-7-[[2-hydroxy-2-(4-phenylphenyl)acetyl]amino]quinoline-5-sulfonic acid Formula: C23H18N2O6S MolecularWeight: 450.46382

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC=C(C=C2)C(C(=O)NC3=CC(=C4C=CC=NC4=C3O)S(=O)(=O)O)O

Isomeric SMILES

C1=CC=C(C=C1)C2=CC=C(C=C2)C(C(=O)NC3=CC(=C4C=CC=NC4=C3O)S(=O)(=O)O)O

InChI

InChI=1S/C23H18N2O6S/c26-21(16-10-8-15(9-11-16)14-5-2-1-3-6-14)23(28)25-18-13-19(32(29,30)31)17-7-4-12-24-20(17)22(18)27/h1-13,21,26-27H,(H,25,28)(H,29,30,31)