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

Systemtic Name: 4-[5-(3,4-dicarboxyphenoxy)cyclohexa-2,4-dien-1-yl]oxyphthalic acid Openeye Name: 4-[5-(3,4-dicarboxyphenoxy)cyclohexa-2,4-dien-1-yl]oxyphthalic acid CAS Name: 4-[[5-(3,4-dicarboxyphenoxy)-1-cyclohexa-2,4-dienyl]oxy]phthalic acid IUPAC Name: 4-[5-(3,4-dicarboxyphenoxy)cyclohexa-2,4-dien-1-yl]oxyphthalic acid Traditional Name: 4-[5-(3,4-dicarboxyphenoxy)cyclohexa-2,4-dien-1-yl]oxyphthalic acid Formula: C22H16O10 MolecularWeight: 440.35644

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C=CC=C1OC2=CC(=C(C=C2)C(=O)O)C(=O)O)OC3=CC(=C(C=C3)C(=O)O)C(=O)O

Isomeric SMILES

C1C(C=CC=C1OC2=CC(=C(C=C2)C(=O)O)C(=O)O)OC3=CC(=C(C=C3)C(=O)O)C(=O)O

InChI

InChI=1S/C22H16O10/c23-19(24)15-6-4-13(9-17(15)21(27)28)31-11-2-1-3-12(8-11)32-14-5-7-16(20(25)26)18(10-14)22(29)30/h1-7,9-11H,8H2,(H,23,24)(H,25,26)(H,27,28)(H,29,30)