3-(3-bromanyl-4-fluoranyl-phenyl)-2-(1,2-oxazol-4-yl)propanoic acid

Systemtic Name: 3-(3-bromanyl-4-fluoranyl-phenyl)-2-(1,2-oxazol-4-yl)propanoic acid Openeye Name: 3-(3-bromo-4-fluoro-phenyl)-2-isoxazol-4-yl-propanoic acid CAS Name: 3-(3-bromo-4-fluorophenyl)-2-(4-isoxazolyl)propanoic acid IUPAC Name: 3-(3-bromo-4-fluorophenyl)-2-(1,2-oxazol-4-yl)propanoic acid Traditional Name: 3-(3-bromo-4-fluoro-phenyl)-2-isoxazol-4-yl-propionic acid Formula: C12H9BrFNO3 MolecularWeight: 314.107163

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1CC(C2=CON=C2)C(=O)O)Br)F

Isomeric SMILES

C1=CC(=C(C=C1CC(C2=CON=C2)C(=O)O)Br)F

InChI

InChI=1S/C12H9BrFNO3/c13-10-4-7(1-2-11(10)14)3-9(12(16)17)8-5-15-18-6-8/h1-2,4-6,9H,3H2,(H,16,17)