4-(2-bromanyl-3-oxidanyl-3-oxidanylidene-propyl)benzoic acid

Systemtic Name: 4-(2-bromanyl-3-oxidanyl-3-oxidanylidene-propyl)benzoic acid Openeye Name: 4-(2-bromo-3-hydroxy-3-oxo-propyl)benzoic acid CAS Name: 4-(2-bromo-3-hydroxy-3-oxopropyl)benzoic acid IUPAC Name: 4-(2-bromo-3-hydroxy-3-oxopropyl)benzoic acid Traditional Name: 4-(2-bromo-3-hydroxy-3-keto-propyl)benzoic acid Formula: C10H9BrO4 MolecularWeight: 273.08006

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CC(C(=O)O)Br)C(=O)O

Isomeric SMILES

C1=CC(=CC=C1CC(C(=O)O)Br)C(=O)O

InChI

InChI=1S/C10H9BrO4/c11-8(10(14)15)5-6-1-3-7(4-2-6)9(12)13/h1-4,8H,5H2,(H,12,13)(H,14,15)