ethyl 4-[4,4,4-tris(fluoranyl)-3-oxidanyl-butanoyl]benzoate

Systemtic Name: ethyl 4-[4,4,4-tris(fluoranyl)-3-oxidanyl-butanoyl]benzoate Openeye Name: ethyl 4-(4,4,4-trifluoro-3-hydroxy-butanoyl)benzoate CAS Name: 4-(4,4,4-trifluoro-3-hydroxy-1-oxobutyl)benzoic acid ethyl ester IUPAC Name: ethyl 4-(4,4,4-trifluoro-3-hydroxybutanoyl)benzoate Traditional Name: 4-(4,4,4-trifluoro-3-hydroxy-butanoyl)benzoic acid ethyl ester Formula: C13H13F3O4 MolecularWeight: 290.23513

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H13F3O4/c1-2-20-12(19)9-5-3-8(4-6-9)10(17)7-11(18)13(14,15)16/h3-6,11,18H,2,7H2,1H3