5-[bis(3-carboxy-4-oxidanyl-phenyl)-oxidanyl-methyl]-2-oxidanyl-benzoic acid

Systemtic Name: 5-[bis(3-carboxy-4-oxidanyl-phenyl)-oxidanyl-methyl]-2-oxidanyl-benzoic acid Openeye Name: 5-[bis(3-carboxy-4-hydroxy-phenyl)-hydroxy-methyl]-2-hydroxy-benzoic acid CAS Name: 5-[bis(3-carboxy-4-hydroxyphenyl)-hydroxymethyl]-2-hydroxybenzoic acid IUPAC Name: 5-[bis(3-carboxy-4-hydroxyphenyl)-hydroxymethyl]-2-hydroxybenzoic acid Traditional Name: 5-[bis(3-carboxy-4-hydroxy-phenyl)-hydroxy-methyl]-2-hydroxy-benzoic acid Formula: C22H16O10 MolecularWeight: 440.35644

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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