4-[3,4-bis(phenoxycarbonyl)phenyl]sulfonylphthalic acid

Systemtic Name: 4-[3,4-bis(phenoxycarbonyl)phenyl]sulfonylphthalic acid Openeye Name: 4-[3,4-bis(phenoxycarbonyl)phenyl]sulfonylphthalic acid CAS Name: 4-[3,4-bis[oxo(phenoxy)methyl]phenyl]sulfonylphthalic acid IUPAC Name: 4-[3,4-bis(phenoxycarbonyl)phenyl]sulfonylphthalic acid Traditional Name: 4-(3,4-dicarbophenoxyphenyl)sulfonylphthalic acid Formula: C28H18O10S MolecularWeight: 546.50152

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC(=O)C2=C(C=C(C=C2)S(=O)(=O)C3=CC(=C(C=C3)C(=O)O)C(=O)O)C(=O)OC4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)OC(=O)C2=C(C=C(C=C2)S(=O)(=O)C3=CC(=C(C=C3)C(=O)O)C(=O)O)C(=O)OC4=CC=CC=C4

InChI

InChI=1S/C28H18O10S/c29-25(30)21-13-11-19(15-23(21)26(31)32)39(35,36)20-12-14-22(27(33)37-17-7-3-1-4-8-17)24(16-20)28(34)38-18-9-5-2-6-10-18/h1-16H,(H,29,30)(H,31,32)