methyl (2S)-3-azanyl-2-[3,3,3-tris(fluoranyl)propoxycarbonylamino]propanoate

Systemtic Name: methyl (2S)-3-azanyl-2-[3,3,3-tris(fluoranyl)propoxycarbonylamino]propanoate Openeye Name: methyl (2S)-3-amino-2-(3,3,3-trifluoropropoxycarbonylamino)propanoate CAS Name: (2S)-3-amino-2-[[oxo(3,3,3-trifluoropropoxy)methyl]amino]propanoic acid methyl ester IUPAC Name: methyl (2S)-3-amino-2-(3,3,3-trifluoropropoxycarbonylamino)propanoate Traditional Name: (2S)-3-amino-2-(3,3,3-trifluoropropoxycarbonylamino)propionic acid methyl ester Formula: C8H13F3N2O4 MolecularWeight: 258.19503

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CN)NC(=O)OCCC(F)(F)F

Isomeric SMILES

COC(=O)[C@H](CN)NC(=O)OCCC(F)(F)F

InChI

InChI=1S/C8H13F3N2O4/c1-16-6(14)5(4-12)13-7(15)17-3-2-8(9,10)11/h5H,2-4,12H2,1H3,(H,13,15)/t5-/m0/s1