2-[[5-oxidanyl-2-(phenylcarbonyl)phenyl]methoxy]-5-(phenylcarbonyl)benzenesulfonic acid

Systemtic Name: 2-[[5-oxidanyl-2-(phenylcarbonyl)phenyl]methoxy]-5-(phenylcarbonyl)benzenesulfonic acid Openeye Name: 5-benzoyl-2-[(2-benzoyl-5-hydroxy-phenyl)methoxy]benzenesulfonic acid CAS Name: 5-benzoyl-2-[(2-benzoyl-5-hydroxyphenyl)methoxy]benzenesulfonic acid IUPAC Name: 5-benzoyl-2-[(2-benzoyl-5-hydroxyphenyl)methoxy]benzenesulfonic acid Traditional Name: 5-benzoyl-2-(2-benzoyl-5-hydroxy-benzyl)oxy-besylic acid Formula: C27H20O7S MolecularWeight: 488.5085

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)C2=CC(=C(C=C2)OCC3=C(C=CC(=C3)O)C(=O)C4=CC=CC=C4)S(=O)(=O)O

Isomeric SMILES

C1=CC=C(C=C1)C(=O)C2=CC(=C(C=C2)OCC3=C(C=CC(=C3)O)C(=O)C4=CC=CC=C4)S(=O)(=O)O

InChI

InChI=1S/C27H20O7S/c28-22-12-13-23(27(30)19-9-5-2-6-10-19)21(15-22)17-34-24-14-11-20(16-25(24)35(31,32)33)26(29)18-7-3-1-4-8-18/h1-16,28H,17H2,(H,31,32,33)