[5-(2-fluorophenyl)-1,2-oxazol-3-yl]methyl 3-bromanylpropanoate

Systemtic Name: [5-(2-fluorophenyl)-1,2-oxazol-3-yl]methyl 3-bromanylpropanoate Openeye Name: [5-(2-fluorophenyl)isoxazol-3-yl]methyl 3-bromopropanoate CAS Name: 3-bromopropanoic acid [5-(2-fluorophenyl)-3-isoxazolyl]methyl ester IUPAC Name: [5-(2-fluorophenyl)-1,2-oxazol-3-yl]methyl 3-bromopropanoate Traditional Name: 3-bromopropionic acid [5-(2-fluorophenyl)isoxazol-3-yl]methyl ester Formula: C13H11BrFNO3 MolecularWeight: 328.133743

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C2=CC(=NO2)COC(=O)CCBr)F

Isomeric SMILES

C1=CC=C(C(=C1)C2=CC(=NO2)COC(=O)CCBr)F

InChI

InChI=1S/C13H11BrFNO3/c14-6-5-13(17)18-8-9-7-12(19-16-9)10-3-1-2-4-11(10)15/h1-4,7H,5-6,8H2