methyl (2S,3R)-3-(4-fluoranyl-3-nitro-phenyl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-oxidanyl-propanoate

Systemtic Name: methyl (2S,3R)-3-(4-fluoranyl-3-nitro-phenyl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-oxidanyl-propanoate Openeye Name: methyl (2S,3R)-2-(tert-butoxycarbonylamino)-3-(4-fluoro-3-nitro-phenyl)-3-hydroxy-propanoate CAS Name: (2S,3R)-3-(4-fluoro-3-nitrophenyl)-3-hydroxy-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]propanoic acid methyl ester IUPAC Name: methyl (2S,3R)-3-(4-fluoro-3-nitrophenyl)-3-hydroxy-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate Traditional Name: (2S,3R)-2-(tert-butoxycarbonylamino)-3-(4-fluoro-3-nitro-phenyl)-3-hydroxy-propionic acid methyl ester Formula: C15H19FN2O7 MolecularWeight: 358.318963

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(C(C1=CC(=C(C=C1)F)[N+](=O)[O-])O)C(=O)OC

Isomeric SMILES

CC(C)(C)OC(=O)N[C@@H]([C@@H](C1=CC(=C(C=C1)F)[N+](=O)[O-])O)C(=O)OC

InChI

InChI=1S/C15H19FN2O7/c1-15(2,3)25-14(21)17-11(13(20)24-4)12(19)8-5-6-9(16)10(7-8)18(22)23/h5-7,11-12,19H,1-4H3,(H,17,21)/t11-,12+/m0/s1