4-[[2-[(3,4-dicarboxyphenyl)-oxidanyl-methyl]phenyl]-oxidanyl-methyl]phthalic acid

Systemtic Name: 4-[[2-[(3,4-dicarboxyphenyl)-oxidanyl-methyl]phenyl]-oxidanyl-methyl]phthalic acid Openeye Name: 4-[[2-[(3,4-dicarboxyphenyl)-hydroxy-methyl]phenyl]-hydroxy-methyl]phthalic acid CAS Name: 4-[[2-[(3,4-dicarboxyphenyl)-hydroxymethyl]phenyl]-hydroxymethyl]phthalic acid IUPAC Name: 4-[[2-[(3,4-dicarboxyphenyl)-hydroxymethyl]phenyl]-hydroxymethyl]phthalic acid Traditional Name: 4-[[2-[(3,4-dicarboxyphenyl)-hydroxy-methyl]phenyl]-hydroxy-methyl]phthalic acid Formula: C24H18O10 MolecularWeight: 466.39372

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(C2=CC(=C(C=C2)C(=O)O)C(=O)O)O)C(C3=CC(=C(C=C3)C(=O)O)C(=O)O)O

Isomeric SMILES

C1=CC=C(C(=C1)C(C2=CC(=C(C=C2)C(=O)O)C(=O)O)O)C(C3=CC(=C(C=C3)C(=O)O)C(=O)O)O

InChI

InChI=1S/C24H18O10/c25-19(11-5-7-15(21(27)28)17(9-11)23(31)32)13-3-1-2-4-14(13)20(26)12-6-8-16(22(29)30)18(10-12)24(33)34/h1-10,19-20,25-26H,(H,27,28)(H,29,30)(H,31,32)(H,33,34)