butyl 2-(3-bromanyl-1,2-oxazol-5-yl)-2-oxidanyl-ethanoate

Systemtic Name: butyl 2-(3-bromanyl-1,2-oxazol-5-yl)-2-oxidanyl-ethanoate Openeye Name: butyl 2-(3-bromoisoxazol-5-yl)-2-hydroxy-acetate CAS Name: 2-(3-bromo-5-isoxazolyl)-2-hydroxyacetic acid butyl ester IUPAC Name: butyl 2-(3-bromo-1,2-oxazol-5-yl)-2-hydroxyacetate Traditional Name: 2-(3-bromoisoxazol-5-yl)-2-hydroxy-acetic acid butyl ester Formula: C9H12BrNO4 MolecularWeight: 278.09988

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C(C1=CC(=NO1)Br)O

Isomeric SMILES

CCCCOC(=O)C(C1=CC(=NO1)Br)O

InChI

InChI=1S/C9H12BrNO4/c1-2-3-4-14-9(13)8(12)6-5-7(10)11-15-6/h5,8,12H,2-4H2,1H3