[1-bromanyl-1-(2-cyanophenoxy)propan-2-yl] ethanoate

Systemtic Name: [1-bromanyl-1-(2-cyanophenoxy)propan-2-yl] ethanoate Openeye Name: [2-bromo-2-(2-cyanophenoxy)-1-methyl-ethyl] acetate CAS Name: acetic acid [1-bromo-1-(2-cyanophenoxy)propan-2-yl] ester IUPAC Name: [1-bromo-1-(2-cyanophenoxy)propan-2-yl] acetate Traditional Name: acetic acid [2-bromo-2-(2-cyanophenoxy)-1-methyl-ethyl] ester Formula: C12H12BrNO3 MolecularWeight: 298.13258

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(OC1=CC=CC=C1C#N)Br)OC(=O)C

Isomeric SMILES

CC(C(OC1=CC=CC=C1C#N)Br)OC(=O)C

InChI

InChI=1S/C12H12BrNO3/c1-8(16-9(2)15)12(13)17-11-6-4-3-5-10(11)7-14/h3-6,8,12H,1-2H3