4-[4-[4-(3,4-dicarboxyphenyl)sulfonylphenoxy]phenyl]sulfonylphthalic acid

Systemtic Name: 4-[4-[4-(3,4-dicarboxyphenyl)sulfonylphenoxy]phenyl]sulfonylphthalic acid Openeye Name: 4-[4-[4-(3,4-dicarboxyphenyl)sulfonylphenoxy]phenyl]sulfonylphthalic acid CAS Name: 4-[4-[4-(3,4-dicarboxyphenyl)sulfonylphenoxy]phenyl]sulfonylphthalic acid IUPAC Name: 4-[4-[4-(3,4-dicarboxyphenyl)sulfonylphenoxy]phenyl]sulfonylphthalic acid Traditional Name: 4-[4-[4-(3,4-dicarboxyphenyl)sulfonylphenoxy]phenyl]sulfonylphthalic acid Formula: C28H18O13S2 MolecularWeight: 626.56472

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1OC2=CC=C(C=C2)S(=O)(=O)C3=CC(=C(C=C3)C(=O)O)C(=O)O)S(=O)(=O)C4=CC(=C(C=C4)C(=O)O)C(=O)O

Isomeric SMILES

C1=CC(=CC=C1OC2=CC=C(C=C2)S(=O)(=O)C3=CC(=C(C=C3)C(=O)O)C(=O)O)S(=O)(=O)C4=CC(=C(C=C4)C(=O)O)C(=O)O

InChI

InChI=1S/C28H18O13S2/c29-25(30)21-11-9-19(13-23(21)27(33)34)42(37,38)17-5-1-15(2-6-17)41-16-3-7-18(8-4-16)43(39,40)20-10-12-22(26(31)32)24(14-20)28(35)36/h1-14H,(H,29,30)(H,31,32)(H,33,34)(H,35,36)