4-[4-[4-(1-benzofuran-3-yl)phenyl]phenoxy]sulfonylbenzoic acid

Systemtic Name: 4-[4-[4-(1-benzofuran-3-yl)phenyl]phenoxy]sulfonylbenzoic acid Openeye Name: 4-[4-[4-(benzofuran-3-yl)phenyl]phenoxy]sulfonylbenzoic acid CAS Name: 4-[4-[4-(3-benzofuranyl)phenyl]phenoxy]sulfonylbenzoic acid IUPAC Name: 4-[4-[4-(1-benzofuran-3-yl)phenyl]phenoxy]sulfonylbenzoic acid Traditional Name: 4-[4-[4-(benzofuran-3-yl)phenyl]phenoxy]sulfonylbenzoic acid Formula: C27H18O6S MolecularWeight: 470.49322

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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

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

InChI

InChI=1S/C27H18O6S/c28-27(29)21-11-15-23(16-12-21)34(30,31)33-22-13-9-19(10-14-22)18-5-7-20(8-6-18)25-17-32-26-4-2-1-3-24(25)26/h1-17H,(H,28,29)