2,3-bis[[3,5-bis(bromanyl)-2-oxidanyl-phenyl]methyl]terephthalic acid

Systemtic Name: 2,3-bis[[3,5-bis(bromanyl)-2-oxidanyl-phenyl]methyl]terephthalic acid Openeye Name: 2,3-bis[(3,5-dibromo-2-hydroxy-phenyl)methyl]terephthalic acid CAS Name: 2,3-bis[(3,5-dibromo-2-hydroxyphenyl)methyl]terephthalic acid IUPAC Name: 2,3-bis[(3,5-dibromo-2-hydroxyphenyl)methyl]terephthalic acid Traditional Name: 2,3-bis(3,5-dibromo-2-hydroxy-benzyl)terephthalic acid Formula: C22H14Br4O6 MolecularWeight: 693.95896

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C(=C1C(=O)O)CC2=CC(=CC(=C2O)Br)Br)CC3=CC(=CC(=C3O)Br)Br)C(=O)O

Isomeric SMILES

C1=CC(=C(C(=C1C(=O)O)CC2=CC(=CC(=C2O)Br)Br)CC3=CC(=CC(=C3O)Br)Br)C(=O)O

InChI

InChI=1S/C22H14Br4O6/c23-11-3-9(19(27)17(25)7-11)5-15-13(21(29)30)1-2-14(22(31)32)16(15)6-10-4-12(24)8-18(26)20(10)28/h1-4,7-8,27-28H,5-6H2,(H,29,30)(H,31,32)