methyl 5-(bromomethyl)-3-(4-chlorophenyl)-1,2-oxazole-4-carboxylate

Systemtic Name: methyl 5-(bromomethyl)-3-(4-chlorophenyl)-1,2-oxazole-4-carboxylate Openeye Name: methyl 5-(bromomethyl)-3-(4-chlorophenyl)isoxazole-4-carboxylate CAS Name: 5-(bromomethyl)-3-(4-chlorophenyl)-4-isoxazolecarboxylic acid methyl ester IUPAC Name: methyl 5-(bromomethyl)-3-(4-chlorophenyl)-1,2-oxazole-4-carboxylate Traditional Name: 5-(bromomethyl)-3-(4-chlorophenyl)isoxazole-4-carboxylic acid methyl ester Formula: C12H9BrClNO3 MolecularWeight: 330.56176

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(ON=C1C2=CC=C(C=C2)Cl)CBr

Isomeric SMILES

COC(=O)C1=C(ON=C1C2=CC=C(C=C2)Cl)CBr

InChI

InChI=1S/C12H9BrClNO3/c1-17-12(16)10-9(6-13)18-15-11(10)7-2-4-8(14)5-3-7/h2-5H,6H2,1H3