3-[4,5-dicarboxy-6-(2,3-dicarboxyphenyl)cyclohex-2-en-1-yl]phthalic acid

Systemtic Name: 3-[4,5-dicarboxy-6-(2,3-dicarboxyphenyl)cyclohex-2-en-1-yl]phthalic acid Openeye Name: 3-[4,5-dicarboxy-6-(2,3-dicarboxyphenyl)cyclohex-2-en-1-yl]phthalic acid CAS Name: 3-[4,5-dicarboxy-6-(2,3-dicarboxyphenyl)-1-cyclohex-2-enyl]phthalic acid IUPAC Name: 3-[4,5-dicarboxy-6-(2,3-dicarboxyphenyl)cyclohex-2-en-1-yl]phthalic acid Traditional Name: 3-[4,5-dicarboxy-6-(2,3-dicarboxyphenyl)cyclohex-2-en-1-yl]phthalic acid Formula: C24H18O12 MolecularWeight: 498.39252

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C(=C1)C2C=CC(C(C2C3=CC=CC(=C3C(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O

Isomeric SMILES

C1=CC(=C(C(=C1)C2C=CC(C(C2C3=CC=CC(=C3C(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O

InChI

InChI=1S/C24H18O12/c25-19(26)12-5-1-3-9(16(12)22(31)32)10-7-8-14(21(29)30)18(24(35)36)15(10)11-4-2-6-13(20(27)28)17(11)23(33)34/h1-8,10,14-15,18H,(H,25,26)(H,27,28)(H,29,30)(H,31,32)(H,33,34)(H,35,36)