(3,5-dimethyl-1,2-oxazol-4-yl)methyl 5-bromanyl-2-oxidanyl-benzoate

Systemtic Name: (3,5-dimethyl-1,2-oxazol-4-yl)methyl 5-bromanyl-2-oxidanyl-benzoate Openeye Name: (3,5-dimethylisoxazol-4-yl)methyl 5-bromo-2-hydroxy-benzoate CAS Name: 5-bromo-2-hydroxybenzoic acid (3,5-dimethyl-4-isoxazolyl)methyl ester IUPAC Name: (3,5-dimethyl-1,2-oxazol-4-yl)methyl 5-bromo-2-hydroxybenzoate Traditional Name: 5-bromo-2-hydroxy-benzoic acid (3,5-dimethylisoxazol-4-yl)methyl ester Formula: C13H12BrNO4 MolecularWeight: 326.14268

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C)COC(=O)C2=C(C=CC(=C2)Br)O

Isomeric SMILES

CC1=C(C(=NO1)C)COC(=O)C2=C(C=CC(=C2)Br)O

InChI

InChI=1S/C13H12BrNO4/c1-7-11(8(2)19-15-7)6-18-13(17)10-5-9(14)3-4-12(10)16/h3-5,16H,6H2,1-2H3