3-[1-(2,3-dicarboxyphenoxy)-4-phenyl-cyclohexa-2,5-dien-1-yl]oxyphthalic acid

Systemtic Name: 3-[1-(2,3-dicarboxyphenoxy)-4-phenyl-cyclohexa-2,5-dien-1-yl]oxyphthalic acid Openeye Name: 3-[1-(2,3-dicarboxyphenoxy)-4-phenyl-cyclohexa-2,5-dien-1-yl]oxyphthalic acid CAS Name: 3-[[1-(2,3-dicarboxyphenoxy)-4-phenyl-1-cyclohexa-2,5-dienyl]oxy]phthalic acid IUPAC Name: 3-[1-(2,3-dicarboxyphenoxy)-4-phenylcyclohexa-2,5-dien-1-yl]oxyphthalic acid Traditional Name: 3-[1-(2,3-dicarboxyphenoxy)-4-phenyl-cyclohexa-2,5-dien-1-yl]oxyphthalic acid Formula: C28H20O10 MolecularWeight: 516.4524

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2C=CC(C=C2)(OC3=CC=CC(=C3C(=O)O)C(=O)O)OC4=CC=CC(=C4C(=O)O)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)C2C=CC(C=C2)(OC3=CC=CC(=C3C(=O)O)C(=O)O)OC4=CC=CC(=C4C(=O)O)C(=O)O

InChI

InChI=1S/C28H20O10/c29-24(30)18-8-4-10-20(22(18)26(33)34)37-28(14-12-17(13-15-28)16-6-2-1-3-7-16)38-21-11-5-9-19(25(31)32)23(21)27(35)36/h1-15,17H,(H,29,30)(H,31,32)(H,33,34)(H,35,36)