(phenylmethyl) 3-oxidanyl-2-[2,2,2-tris(fluoranyl)ethanoylamino]propanoate

Systemtic Name: (phenylmethyl) 3-oxidanyl-2-[2,2,2-tris(fluoranyl)ethanoylamino]propanoate Openeye Name: benzyl 3-hydroxy-2-[(2,2,2-trifluoroacetyl)amino]propanoate CAS Name: 3-hydroxy-2-[(2,2,2-trifluoro-1-oxoethyl)amino]propanoic acid (phenylmethyl) ester IUPAC Name: benzyl 3-hydroxy-2-[(2,2,2-trifluoroacetyl)amino]propanoate Traditional Name: 3-hydroxy-2-[(2,2,2-trifluoroacetyl)amino]propionic acid benzyl ester Formula: C12H12F3NO4 MolecularWeight: 291.22319

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)C(CO)NC(=O)C(F)(F)F

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)C(CO)NC(=O)C(F)(F)F

InChI

InChI=1S/C12H12F3NO4/c13-12(14,15)11(19)16-9(6-17)10(18)20-7-8-4-2-1-3-5-8/h1-5,9,17H,6-7H2,(H,16,19)