ethyl 2-[(4-ethanoylphenyl)methyl]-4,4,4-tris(fluoranyl)-3-oxidanylidene-butanoate

Systemtic Name: ethyl 2-[(4-ethanoylphenyl)methyl]-4,4,4-tris(fluoranyl)-3-oxidanylidene-butanoate Openeye Name: ethyl 2-[(4-acetylphenyl)methyl]-4,4,4-trifluoro-3-oxo-butanoate CAS Name: 2-[(4-acetylphenyl)methyl]-4,4,4-trifluoro-3-oxobutanoic acid ethyl ester IUPAC Name: ethyl 2-[(4-acetylphenyl)methyl]-4,4,4-trifluoro-3-oxobutanoate Traditional Name: 2-(4-acetylbenzyl)-4,4,4-trifluoro-3-keto-butyric acid ethyl ester Formula: C15H15F3O4 MolecularWeight: 316.27241

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H15F3O4/c1-3-22-14(21)12(13(20)15(16,17)18)8-10-4-6-11(7-5-10)9(2)19/h4-7,12H,3,8H2,1-2H3