4-[4-[4-(1-benzofuran-3-yl)phenyl]phenoxy]sulfonyl-2-oxidanyl-benzoic acid

Systemtic Name: 4-[4-[4-(1-benzofuran-3-yl)phenyl]phenoxy]sulfonyl-2-oxidanyl-benzoic acid Openeye Name: 4-[4-[4-(benzofuran-3-yl)phenyl]phenoxy]sulfonyl-2-hydroxy-benzoic acid CAS Name: 4-[4-[4-(3-benzofuranyl)phenyl]phenoxy]sulfonyl-2-hydroxybenzoic acid IUPAC Name: 4-[4-[4-(1-benzofuran-3-yl)phenyl]phenoxy]sulfonyl-2-hydroxybenzoic acid Traditional Name: 4-[4-[4-(benzofuran-3-yl)phenyl]phenoxy]sulfonyl-2-hydroxy-benzoic acid Formula: C27H18O7S MolecularWeight: 486.49262

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CO2)C3=CC=C(C=C3)C4=CC=C(C=C4)OS(=O)(=O)C5=CC(=C(C=C5)C(=O)O)O

Isomeric SMILES

C1=CC=C2C(=C1)C(=CO2)C3=CC=C(C=C3)C4=CC=C(C=C4)OS(=O)(=O)C5=CC(=C(C=C5)C(=O)O)O

InChI

InChI=1S/C27H18O7S/c28-25-15-21(13-14-23(25)27(29)30)35(31,32)34-20-11-9-18(10-12-20)17-5-7-19(8-6-17)24-16-33-26-4-2-1-3-22(24)26/h1-16,28H,(H,29,30)