ethyl 4-[3,5-bis(trifluoromethyl)phenyl]-4-oxidanylidene-butanoate

Systemtic Name: ethyl 4-[3,5-bis(trifluoromethyl)phenyl]-4-oxidanylidene-butanoate Openeye Name: ethyl 4-[3,5-bis(trifluoromethyl)phenyl]-4-oxo-butanoate CAS Name: 4-[3,5-bis(trifluoromethyl)phenyl]-4-oxobutanoic acid ethyl ester IUPAC Name: ethyl 4-[3,5-bis(trifluoromethyl)phenyl]-4-oxobutanoate Traditional Name: 4-[3,5-bis(trifluoromethyl)phenyl]-4-keto-butyric acid ethyl ester Formula: C14H12F6O3 MolecularWeight: 342.233699

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H12F6O3/c1-2-23-12(22)4-3-11(21)8-5-9(13(15,16)17)7-10(6-8)14(18,19)20/h5-7H,2-4H2,1H3