3-[3-(3-carboxy-2-oxidanyl-phenyl)carbonyl-5-chloranyl-2-oxidanyl-phenyl]carbonyl-2-oxidanyl-benzoic acid

Systemtic Name: 3-[3-(3-carboxy-2-oxidanyl-phenyl)carbonyl-5-chloranyl-2-oxidanyl-phenyl]carbonyl-2-oxidanyl-benzoic acid Openeye Name: 3-[3-(3-carboxy-2-hydroxy-benzoyl)-5-chloro-2-hydroxy-benzoyl]-2-hydroxy-benzoic acid CAS Name: 3-[[3-[(3-carboxy-2-hydroxyphenyl)-oxomethyl]-5-chloro-2-hydroxyphenyl]-oxomethyl]-2-hydroxybenzoic acid IUPAC Name: 3-[3-(3-carboxy-2-hydroxybenzoyl)-5-chloro-2-hydroxybenzoyl]-2-hydroxybenzoic acid Traditional Name: 3-[3-(3-carboxy-2-hydroxy-benzoyl)-5-chloro-2-hydroxy-benzoyl]-2-hydroxy-benzoic acid Formula: C22H13ClO9 MolecularWeight: 456.78622

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C(=C1)C(=O)O)O)C(=O)C2=CC(=CC(=C2O)C(=O)C3=C(C(=CC=C3)C(=O)O)O)Cl

Isomeric SMILES

C1=CC(=C(C(=C1)C(=O)O)O)C(=O)C2=CC(=CC(=C2O)C(=O)C3=C(C(=CC=C3)C(=O)O)O)Cl

InChI

InChI=1S/C22H13ClO9/c23-9-7-14(18(26)10-3-1-5-12(16(10)24)21(29)30)20(28)15(8-9)19(27)11-4-2-6-13(17(11)25)22(31)32/h1-8,24-25,28H,(H,29,30)(H,31,32)