(5,5-dimethyl-3-phenyl-4H-1,2-oxazol-4-yl) ethanoate

Systemtic Name: (5,5-dimethyl-3-phenyl-4H-1,2-oxazol-4-yl) ethanoate Openeye Name: (5,5-dimethyl-3-phenyl-4H-isoxazol-4-yl) acetate CAS Name: acetic acid (5,5-dimethyl-3-phenyl-4H-isoxazol-4-yl) ester IUPAC Name: (5,5-dimethyl-3-phenyl-4H-1,2-oxazol-4-yl) acetate Traditional Name: acetic acid (5,5-dimethyl-3-phenyl-2-isoxazolin-4-yl) ester Formula: C13H15NO3 MolecularWeight: 233.2631

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1C(=NOC1(C)C)C2=CC=CC=C2

Isomeric SMILES

CC(=O)OC1C(=NOC1(C)C)C2=CC=CC=C2

InChI

InChI=1S/C13H15NO3/c1-9(15)16-12-11(14-17-13(12,2)3)10-7-5-4-6-8-10/h4-8,12H,1-3H3