methyl 4,4,4-tris(fluoranyl)-3-oxidanyl-2-(phenylmethoxycarbonylamino)butanoate

Systemtic Name: methyl 4,4,4-tris(fluoranyl)-3-oxidanyl-2-(phenylmethoxycarbonylamino)butanoate Openeye Name: methyl 2-(benzyloxycarbonylamino)-4,4,4-trifluoro-3-hydroxy-butanoate CAS Name: 4,4,4-trifluoro-3-hydroxy-2-(phenylmethoxycarbonylamino)butanoic acid methyl ester IUPAC Name: methyl 4,4,4-trifluoro-3-hydroxy-2-(phenylmethoxycarbonylamino)butanoate Traditional Name: 2-(benzyloxycarbonylamino)-4,4,4-trifluoro-3-hydroxy-butyric acid methyl ester Formula: C13H14F3NO5 MolecularWeight: 321.24917

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(C(C(F)(F)F)O)NC(=O)OCC1=CC=CC=C1

Isomeric SMILES

COC(=O)C(C(C(F)(F)F)O)NC(=O)OCC1=CC=CC=C1

InChI

InChI=1S/C13H14F3NO5/c1-21-11(19)9(10(18)13(14,15)16)17-12(20)22-7-8-5-3-2-4-6-8/h2-6,9-10,18H,7H2,1H3,(H,17,20)