[2-(trifluoromethyl)pyrimidin-5-yl] 3,3-dimethylbutanoate

Systemtic Name: [2-(trifluoromethyl)pyrimidin-5-yl] 3,3-dimethylbutanoate Openeye Name: [2-(trifluoromethyl)pyrimidin-5-yl] 3,3-dimethylbutanoate CAS Name: 3,3-dimethylbutanoic acid [2-(trifluoromethyl)-5-pyrimidinyl] ester IUPAC Name: [2-(trifluoromethyl)pyrimidin-5-yl] 3,3-dimethylbutanoate Traditional Name: 3,3-dimethylbutyric acid [2-(trifluoromethyl)pyrimidin-5-yl] ester Formula: C11H13F3N2O2 MolecularWeight: 262.22833

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CC(=O)OC1=CN=C(N=C1)C(F)(F)F

Isomeric SMILES

CC(C)(C)CC(=O)OC1=CN=C(N=C1)C(F)(F)F

InChI

InChI=1S/C11H13F3N2O2/c1-10(2,3)4-8(17)18-7-5-15-9(16-6-7)11(12,13)14/h5-6H,4H2,1-3H3