3,4-bis(2,3-dicarboxyphenyl)-5,6-dimethyl-phthalic acid

Systemtic Name: 3,4-bis(2,3-dicarboxyphenyl)-5,6-dimethyl-phthalic acid Openeye Name: 3,4-bis(2,3-dicarboxyphenyl)-5,6-dimethyl-phthalic acid CAS Name: 3,4-bis(2,3-dicarboxyphenyl)-5,6-dimethylphthalic acid IUPAC Name: 3,4-bis(2,3-dicarboxyphenyl)-5,6-dimethylphthalic acid Traditional Name: 3,4-bis(2,3-dicarboxyphenyl)-5,6-dimethyl-phthalic acid Formula: C26H18O12 MolecularWeight: 522.41392

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C(=C1C2=C(C(=CC=C2)C(=O)O)C(=O)O)C3=C(C(=CC=C3)C(=O)O)C(=O)O)C(=O)O)C(=O)O)C

Isomeric SMILES

CC1=C(C(=C(C(=C1C2=C(C(=CC=C2)C(=O)O)C(=O)O)C3=C(C(=CC=C3)C(=O)O)C(=O)O)C(=O)O)C(=O)O)C

InChI

InChI=1S/C26H18O12/c1-9-10(2)16(23(31)32)20(26(37)38)19(12-6-4-8-14(22(29)30)18(12)25(35)36)15(9)11-5-3-7-13(21(27)28)17(11)24(33)34/h3-8H,1-2H3,(H,27,28)(H,29,30)(H,31,32)(H,33,34)(H,35,36)(H,37,38)