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

Systemtic Name: 2,2-bis[[3,5-bis(bromanyl)-2-oxidanyl-phenyl]methyl]pentanedioic acid Openeye Name: 2,2-bis[(3,5-dibromo-2-hydroxy-phenyl)methyl]pentanedioic acid CAS Name: 2,2-bis[(3,5-dibromo-2-hydroxyphenyl)methyl]pentanedioic acid IUPAC Name: 2,2-bis[(3,5-dibromo-2-hydroxyphenyl)methyl]pentanedioic acid Traditional Name: 2,2-bis(3,5-dibromo-2-hydroxy-benzyl)glutaric acid Formula: C19H16Br4O6 MolecularWeight: 659.94274

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=C(C(=C1Br)O)CC(CCC(=O)O)(CC2=CC(=CC(=C2O)Br)Br)C(=O)O)Br

Isomeric SMILES

C1=C(C=C(C(=C1Br)O)CC(CCC(=O)O)(CC2=CC(=CC(=C2O)Br)Br)C(=O)O)Br

InChI

InChI=1S/C19H16Br4O6/c20-11-3-9(16(26)13(22)5-11)7-19(18(28)29,2-1-15(24)25)8-10-4-12(21)6-14(23)17(10)27/h3-6,26-27H,1-2,7-8H2,(H,24,25)(H,28,29)