3-[bis[3-carboxy-2,5-bis(oxidanyl)phenyl]methyl]-2,5-bis(oxidanyl)benzoic acid

Systemtic Name: 3-[bis[3-carboxy-2,5-bis(oxidanyl)phenyl]methyl]-2,5-bis(oxidanyl)benzoic acid Openeye Name: 3-[bis(3-carboxy-2,5-dihydroxy-phenyl)methyl]-2,5-dihydroxy-benzoic acid CAS Name: 3-[bis(3-carboxy-2,5-dihydroxyphenyl)methyl]-2,5-dihydroxybenzoic acid IUPAC Name: 3-[bis(3-carboxy-2,5-dihydroxyphenyl)methyl]-2,5-dihydroxybenzoic acid Traditional Name: 3-[bis(3-carboxy-2,5-dihydroxy-phenyl)methyl]-2,5-dihydroxy-benzoic acid Formula: C22H16O12 MolecularWeight: 472.35524

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=C(C(=C1C(C2=C(C(=CC(=C2)O)C(=O)O)O)C3=C(C(=CC(=C3)O)C(=O)O)O)O)C(=O)O)O

Isomeric SMILES

C1=C(C=C(C(=C1C(C2=C(C(=CC(=C2)O)C(=O)O)O)C3=C(C(=CC(=C3)O)C(=O)O)O)O)C(=O)O)O

InChI

InChI=1S/C22H16O12/c23-7-1-10(17(26)13(4-7)20(29)30)16(11-2-8(24)5-14(18(11)27)21(31)32)12-3-9(25)6-15(19(12)28)22(33)34/h1-6,16,23-28H,(H,29,30)(H,31,32)(H,33,34)