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

Systemtic Name: ethyl (2S)-3,3,3-tris(fluoranyl)-2-phenylazanyl-2-(pyridin-3-ylcarbonylamino)propanoate Openeye Name: ethyl (2S)-2-anilino-3,3,3-trifluoro-2-(pyridine-3-carbonylamino)propanoate CAS Name: (2S)-2-anilino-3,3,3-trifluoro-2-[[oxo(3-pyridinyl)methyl]amino]propanoic acid ethyl ester IUPAC Name: ethyl (2S)-2-anilino-3,3,3-trifluoro-2-(pyridine-3-carbonylamino)propanoate Traditional Name: (2S)-2-anilino-3,3,3-trifluoro-2-nicotinamido-propionic acid ethyl ester Formula: C17H16F3N3O3 MolecularWeight: 367.32245

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H16F3N3O3/c1-2-26-15(25)16(17(18,19)20,22-13-8-4-3-5-9-13)23-14(24)12-7-6-10-21-11-12/h3-11,22H,2H2,1H3,(H,23,24)/t16-/m0/s1