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

Systemtic Name: 3-[[5-chloranyl-3-[(2-hydroxyphenyl)methyl]-2-oxidanyl-phenyl]methyl]-2-oxidanyl-benzoic acid Openeye Name: 3-[[5-chloro-2-hydroxy-3-[(2-hydroxyphenyl)methyl]phenyl]methyl]-2-hydroxy-benzoic acid CAS Name: 3-[[5-chloro-2-hydroxy-3-[(2-hydroxyphenyl)methyl]phenyl]methyl]-2-hydroxybenzoic acid IUPAC Name: 3-[[5-chloro-2-hydroxy-3-[(2-hydroxyphenyl)methyl]phenyl]methyl]-2-hydroxybenzoic acid Traditional Name: 3-(5-chloro-2-hydroxy-3-salicyl-benzyl)-2-hydroxy-benzoic acid Formula: C21H17ClO5 MolecularWeight: 384.80968

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CC2=CC(=CC(=C2O)CC3=CC=CC(=C3O)C(=O)O)Cl)O

Isomeric SMILES

C1=CC=C(C(=C1)CC2=CC(=CC(=C2O)CC3=CC=CC(=C3O)C(=O)O)Cl)O

InChI

InChI=1S/C21H17ClO5/c22-16-10-14(8-12-4-1-2-7-18(12)23)19(24)15(11-16)9-13-5-3-6-17(20(13)25)21(26)27/h1-7,10-11,23-25H,8-9H2,(H,26,27)