(phenylmethyl) 2-acetamido-4,4,4-tris(fluoranyl)butanoate

Systemtic Name: (phenylmethyl) 2-acetamido-4,4,4-tris(fluoranyl)butanoate Openeye Name: benzyl 2-acetamido-4,4,4-trifluoro-butanoate CAS Name: 2-acetamido-4,4,4-trifluorobutanoic acid (phenylmethyl) ester IUPAC Name: benzyl 2-acetamido-4,4,4-trifluorobutanoate Traditional Name: 2-acetamido-4,4,4-trifluoro-butyric acid benzyl ester Formula: C13H14F3NO3 MolecularWeight: 289.25037

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(CC(F)(F)F)C(=O)OCC1=CC=CC=C1

Isomeric SMILES

CC(=O)NC(CC(F)(F)F)C(=O)OCC1=CC=CC=C1

InChI

InChI=1S/C13H14F3NO3/c1-9(18)17-11(7-13(14,15)16)12(19)20-8-10-5-3-2-4-6-10/h2-6,11H,7-8H2,1H3,(H,17,18)