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

Systemtic Name: ethyl 2-[(4-bromophenyl)methyl]-4,4,4-tris(fluoranyl)-3-oxidanylidene-butanoate Openeye Name: ethyl 2-[(4-bromophenyl)methyl]-4,4,4-trifluoro-3-oxo-butanoate CAS Name: 2-[(4-bromophenyl)methyl]-4,4,4-trifluoro-3-oxobutanoic acid ethyl ester IUPAC Name: ethyl 2-[(4-bromophenyl)methyl]-4,4,4-trifluoro-3-oxobutanoate Traditional Name: 2-(4-bromobenzyl)-4,4,4-trifluoro-3-keto-butyric acid ethyl ester Formula: C13H12BrF3O3 MolecularWeight: 353.13179

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H12BrF3O3/c1-2-20-12(19)10(11(18)13(15,16)17)7-8-3-5-9(14)6-4-8/h3-6,10H,2,7H2,1H3