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

Systemtic Name: 5-bromanyl-3-[[3-[(5-bromanyl-2-oxidanyl-phenyl)methyl]-5-chloranyl-2-oxidanyl-phenyl]methyl]-2-oxidanyl-benzoic acid Openeye Name: 5-bromo-3-[[3-[(5-bromo-2-hydroxy-phenyl)methyl]-5-chloro-2-hydroxy-phenyl]methyl]-2-hydroxy-benzoic acid CAS Name: 5-bromo-3-[[3-[(5-bromo-2-hydroxyphenyl)methyl]-5-chloro-2-hydroxyphenyl]methyl]-2-hydroxybenzoic acid IUPAC Name: 5-bromo-3-[[3-[(5-bromo-2-hydroxyphenyl)methyl]-5-chloro-2-hydroxyphenyl]methyl]-2-hydroxybenzoic acid Traditional Name: 5-bromo-3-[3-(5-bromo-2-hydroxy-benzyl)-5-chloro-2-hydroxy-benzyl]-2-hydroxy-benzoic acid Formula: C21H15Br2ClO5 MolecularWeight: 542.6018

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1Br)CC2=CC(=CC(=C2O)CC3=C(C(=CC(=C3)Br)C(=O)O)O)Cl)O

Isomeric SMILES

C1=CC(=C(C=C1Br)CC2=CC(=CC(=C2O)CC3=C(C(=CC(=C3)Br)C(=O)O)O)Cl)O

InChI

InChI=1S/C21H15Br2ClO5/c22-14-1-2-18(25)10(5-14)3-12-7-16(24)8-13(19(12)26)4-11-6-15(23)9-17(20(11)27)21(28)29/h1-2,5-9,25-27H,3-4H2,(H,28,29)