butyl 2-(3-bromanyl-1,2-oxazol-4-yl)-2-oxidanyl-ethanoate

Systemtic Name: butyl 2-(3-bromanyl-1,2-oxazol-4-yl)-2-oxidanyl-ethanoate Openeye Name: butyl 2-(3-bromoisoxazol-4-yl)-2-hydroxy-acetate CAS Name: 2-(3-bromo-4-isoxazolyl)-2-hydroxyacetic acid butyl ester IUPAC Name: butyl 2-(3-bromo-1,2-oxazol-4-yl)-2-hydroxyacetate Traditional Name: 2-(3-bromoisoxazol-4-yl)-2-hydroxy-acetic acid butyl ester Formula: C9H12BrNO4 MolecularWeight: 278.09988

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C(C1=CON=C1Br)O

Isomeric SMILES

CCCCOC(=O)C(C1=CON=C1Br)O

InChI

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