methyl 3-oxidanylidene-4-[4-(trifluoromethyl)phenyl]butanoate

Systemtic Name: methyl 3-oxidanylidene-4-[4-(trifluoromethyl)phenyl]butanoate Openeye Name: methyl 3-oxo-4-[4-(trifluoromethyl)phenyl]butanoate CAS Name: 3-oxo-4-[4-(trifluoromethyl)phenyl]butanoic acid methyl ester IUPAC Name: methyl 3-oxo-4-[4-(trifluoromethyl)phenyl]butanoate Traditional Name: 3-keto-4-[4-(trifluoromethyl)phenyl]butyric acid methyl ester Formula: C12H11F3O3 MolecularWeight: 260.20915

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC(=O)CC1=CC=C(C=C1)C(F)(F)F

Isomeric SMILES

COC(=O)CC(=O)CC1=CC=C(C=C1)C(F)(F)F

InChI

InChI=1S/C12H11F3O3/c1-18-11(17)7-10(16)6-8-2-4-9(5-3-8)12(13,14)15/h2-5H,6-7H2,1H3