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

Systemtic Name: 3-[5-chloranyl-3-(2-hydroxyphenyl)carbonyl-2-oxidanyl-phenyl]carbonyl-2-oxidanyl-benzoic acid Openeye Name: 3-[5-chloro-2-hydroxy-3-(2-hydroxybenzoyl)benzoyl]-2-hydroxy-benzoic acid CAS Name: 3-[[5-chloro-2-hydroxy-3-[(2-hydroxyphenyl)-oxomethyl]phenyl]-oxomethyl]-2-hydroxybenzoic acid IUPAC Name: 3-[5-chloro-2-hydroxy-3-(2-hydroxybenzoyl)benzoyl]-2-hydroxybenzoic acid Traditional Name: 3-(5-chloro-2-hydroxy-3-salicyloyl-benzoyl)-2-hydroxy-benzoic acid Formula: C21H13ClO7 MolecularWeight: 412.77672

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H13ClO7/c22-10-8-14(17(24)11-4-1-2-7-16(11)23)20(27)15(9-10)19(26)12-5-3-6-13(18(12)25)21(28)29/h1-9,23,25,27H,(H,28,29)