ethyl (2S)-3,3,3-tris(fluoranyl)-2-(furan-2-ylcarbonylamino)-2-phenylazanyl-propanoate

Systemtic Name: ethyl (2S)-3,3,3-tris(fluoranyl)-2-(furan-2-ylcarbonylamino)-2-phenylazanyl-propanoate Openeye Name: ethyl (2S)-2-anilino-3,3,3-trifluoro-2-(furan-2-carbonylamino)propanoate CAS Name: (2S)-2-anilino-3,3,3-trifluoro-2-[[2-furanyl(oxo)methyl]amino]propanoic acid ethyl ester IUPAC Name: ethyl (2S)-2-anilino-3,3,3-trifluoro-2-(furan-2-carbonylamino)propanoate Traditional Name: (2S)-2-anilino-3,3,3-trifluoro-2-(2-furoylamino)propionic acid ethyl ester Formula: C16H15F3N2O4 MolecularWeight: 356.29651

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C(F)(F)F)(NC1=CC=CC=C1)NC(=O)C2=CC=CO2

Isomeric SMILES

CCOC(=O)[C@](C(F)(F)F)(NC1=CC=CC=C1)NC(=O)C2=CC=CO2

InChI

InChI=1S/C16H15F3N2O4/c1-2-24-14(23)15(16(17,18)19,20-11-7-4-3-5-8-11)21-13(22)12-9-6-10-25-12/h3-10,20H,2H2,1H3,(H,21,22)/t15-/m0/s1