2-[5-(3-bromanyl-4-chloranyl-phenyl)-1,2-oxazol-4-yl]propanoic acid

Systemtic Name: 2-[5-(3-bromanyl-4-chloranyl-phenyl)-1,2-oxazol-4-yl]propanoic acid Openeye Name: 2-[5-(3-bromo-4-chloro-phenyl)isoxazol-4-yl]propanoic acid CAS Name: 2-[5-(3-bromo-4-chlorophenyl)-4-isoxazolyl]propanoic acid IUPAC Name: 2-[5-(3-bromo-4-chlorophenyl)-1,2-oxazol-4-yl]propanoic acid Traditional Name: 2-[5-(3-bromo-4-chloro-phenyl)isoxazol-4-yl]propionic acid Formula: C12H9BrClNO3 MolecularWeight: 330.56176

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=C(ON=C1)C2=CC(=C(C=C2)Cl)Br)C(=O)O

Isomeric SMILES

CC(C1=C(ON=C1)C2=CC(=C(C=C2)Cl)Br)C(=O)O

InChI

InChI=1S/C12H9BrClNO3/c1-6(12(16)17)8-5-15-18-11(8)7-2-3-10(14)9(13)4-7/h2-6H,1H3,(H,16,17)