sodium 5-[[5-(4-hydroxyphenyl)sulfonyl-2-oxidanyl-phenyl]methyl]naphthalene-2-sulfonate

Systemtic Name: sodium 5-[[5-(4-hydroxyphenyl)sulfonyl-2-oxidanyl-phenyl]methyl]naphthalene-2-sulfonate Openeye Name: sodium 5-[[2-hydroxy-5-(4-hydroxyphenyl)sulfonyl-phenyl]methyl]naphthalene-2-sulfonate CAS Name: sodium 5-[[2-hydroxy-5-(4-hydroxyphenyl)sulfonylphenyl]methyl]-2-naphthalenesulfonate IUPAC Name: sodium 5-[[2-hydroxy-5-(4-hydroxyphenyl)sulfonylphenyl]methyl]naphthalene-2-sulfonate Traditional Name: sodium 5-[2-hydroxy-5-(4-hydroxyphenyl)sulfonyl-benzyl]naphthalene-2-sulfonate Formula: C23H17NaO7S2 MolecularWeight: 492.49665

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=CC(=C2)S(=O)(=O)[O-])C(=C1)CC3=C(C=CC(=C3)S(=O)(=O)C4=CC=C(C=C4)O)O.[Na+]

Isomeric SMILES

C1=CC2=C(C=CC(=C2)S(=O)(=O)[O-])C(=C1)CC3=C(C=CC(=C3)S(=O)(=O)C4=CC=C(C=C4)O)O.[Na+]

InChI

InChI=1S/C23H18O7S2.Na/c24-18-4-6-19(7-5-18)31(26,27)20-9-11-23(25)17(14-20)12-15-2-1-3-16-13-21(32(28,29)30)8-10-22(15)16;/h1-11,13-14,24-25H,12H2,(H,28,29,30);/q;+1/p-1