ethyl (2R)-3,3,3-tris(fluoranyl)-2-[(5-methyl-1,2-oxazol-3-yl)amino]-2-(propanoylamino)propanoate

Systemtic Name: ethyl (2R)-3,3,3-tris(fluoranyl)-2-[(5-methyl-1,2-oxazol-3-yl)amino]-2-(propanoylamino)propanoate Openeye Name: ethyl (2R)-3,3,3-trifluoro-2-[(5-methylisoxazol-3-yl)amino]-2-(propanoylamino)propanoate CAS Name: (2R)-3,3,3-trifluoro-2-[(5-methyl-3-isoxazolyl)amino]-2-(1-oxopropylamino)propanoic acid ethyl ester IUPAC Name: ethyl (2R)-3,3,3-trifluoro-2-[(5-methyl-1,2-oxazol-3-yl)amino]-2-(propanoylamino)propanoate Traditional Name: (2R)-3,3,3-trifluoro-2-[(5-methylisoxazol-3-yl)amino]-2-propionamido-propionic acid ethyl ester Formula: C12H16F3N3O4 MolecularWeight: 323.26835

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC(C(=O)OCC)(C(F)(F)F)NC1=NOC(=C1)C

Isomeric SMILES

CCC(=O)N[C@](C(=O)OCC)(C(F)(F)F)NC1=NOC(=C1)C

InChI

InChI=1S/C12H16F3N3O4/c1-4-9(19)17-11(12(13,14)15,10(20)21-5-2)16-8-6-7(3)22-18-8/h6H,4-5H2,1-3H3,(H,16,18)(H,17,19)/t11-/m1/s1