ethyl 4-[3,5-bis(fluoranyl)phenyl]-2,2-dimethyl-4-oxidanylidene-butanoate

Systemtic Name: ethyl 4-[3,5-bis(fluoranyl)phenyl]-2,2-dimethyl-4-oxidanylidene-butanoate Openeye Name: ethyl 4-(3,5-difluorophenyl)-2,2-dimethyl-4-oxo-butanoate CAS Name: 4-(3,5-difluorophenyl)-2,2-dimethyl-4-oxobutanoic acid ethyl ester IUPAC Name: ethyl 4-(3,5-difluorophenyl)-2,2-dimethyl-4-oxobutanoate Traditional Name: 4-(3,5-difluorophenyl)-4-keto-2,2-dimethyl-butyric acid ethyl ester Formula: C14H16F2O3 MolecularWeight: 270.271846

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C)(C)CC(=O)C1=CC(=CC(=C1)F)F

Isomeric SMILES

CCOC(=O)C(C)(C)CC(=O)C1=CC(=CC(=C1)F)F

InChI

InChI=1S/C14H16F2O3/c1-4-19-13(18)14(2,3)8-12(17)9-5-10(15)7-11(16)6-9/h5-7H,4,8H2,1-3H3