tert-butyl 3-[4-(bromomethyloxy)-3-chloranyl-phenyl]-5-methyl-1,2-oxazole-4-carboxylate

Systemtic Name: tert-butyl 3-[4-(bromomethyloxy)-3-chloranyl-phenyl]-5-methyl-1,2-oxazole-4-carboxylate Openeye Name: tert-butyl 3-[4-(bromomethoxy)-3-chloro-phenyl]-5-methyl-isoxazole-4-carboxylate CAS Name: 3-[4-(bromomethoxy)-3-chlorophenyl]-5-methyl-4-isoxazolecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 3-[4-(bromomethoxy)-3-chlorophenyl]-5-methyl-1,2-oxazole-4-carboxylate Traditional Name: 3-[4-(bromomethoxy)-3-chloro-phenyl]-5-methyl-isoxazole-4-carboxylic acid tert-butyl ester Formula: C16H17BrClNO4 MolecularWeight: 402.66748

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C2=CC(=C(C=C2)OCBr)Cl)C(=O)OC(C)(C)C

Isomeric SMILES

CC1=C(C(=NO1)C2=CC(=C(C=C2)OCBr)Cl)C(=O)OC(C)(C)C

InChI

InChI=1S/C16H17BrClNO4/c1-9-13(15(20)22-16(2,3)4)14(19-23-9)10-5-6-12(21-8-17)11(18)7-10/h5-7H,8H2,1-4H3