4-[2,4-dicarboxy-3-(4-carboxylatophenyl)phenyl]benzoate

Systemtic Name: 4-[2,4-dicarboxy-3-(4-carboxylatophenyl)phenyl]benzoate Openeye Name: 4-[2,4-dicarboxy-3-(4-carboxylatophenyl)phenyl]benzoate CAS Name: 4-[2,4-dicarboxy-3-(4-carboxylatophenyl)phenyl]benzoate IUPAC Name: 4-[2,4-dicarboxy-3-(4-carboxylatophenyl)phenyl]benzoate Traditional Name: 4-[2,4-dicarboxy-3-(4-carboxylatophenyl)phenyl]benzoate Formula: C22H12O8-2 MolecularWeight: 404.32588

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=C(C(=C(C=C2)C(=O)O)C3=CC=C(C=C3)C(=O)[O-])C(=O)O)C(=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1C2=C(C(=C(C=C2)C(=O)O)C3=CC=C(C=C3)C(=O)[O-])C(=O)O)C(=O)[O-]

InChI

InChI=1S/C22H14O8/c23-19(24)13-5-1-11(2-6-13)15-9-10-16(21(27)28)17(18(15)22(29)30)12-3-7-14(8-4-12)20(25)26/h1-10H,(H,23,24)(H,25,26)(H,27,28)(H,29,30)/p-2