4-[4-[4-(3,4-dicarboxyphenyl)carbonylphenyl]sulfonylphenyl]carbonylphthalic acid

Systemtic Name: 4-[4-[4-(3,4-dicarboxyphenyl)carbonylphenyl]sulfonylphenyl]carbonylphthalic acid Openeye Name: 4-[4-[4-(3,4-dicarboxybenzoyl)phenyl]sulfonylbenzoyl]phthalic acid CAS Name: 4-[[4-[4-[(3,4-dicarboxyphenyl)-oxomethyl]phenyl]sulfonylphenyl]-oxomethyl]phthalic acid IUPAC Name: 4-[4-[4-(3,4-dicarboxybenzoyl)phenyl]sulfonylbenzoyl]phthalic acid Traditional Name: 4-[4-[4-(3,4-dicarboxybenzoyl)phenyl]sulfonylbenzoyl]phthalic acid Formula: C30H18O12S MolecularWeight: 602.52172

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)C2=CC(=C(C=C2)C(=O)O)C(=O)O)S(=O)(=O)C3=CC=C(C=C3)C(=O)C4=CC(=C(C=C4)C(=O)O)C(=O)O

Isomeric SMILES

C1=CC(=CC=C1C(=O)C2=CC(=C(C=C2)C(=O)O)C(=O)O)S(=O)(=O)C3=CC=C(C=C3)C(=O)C4=CC(=C(C=C4)C(=O)O)C(=O)O

InChI

InChI=1S/C30H18O12S/c31-25(17-5-11-21(27(33)34)23(13-17)29(37)38)15-1-7-19(8-2-15)43(41,42)20-9-3-16(4-10-20)26(32)18-6-12-22(28(35)36)24(14-18)30(39)40/h1-14H,(H,33,34)(H,35,36)(H,37,38)(H,39,40)