(phenylmethyl) (2S,3R)-2-methyl-3-(2-nitrophenyl)-3-oxidanyl-2-(phenylmethoxycarbonylamino)propanoate

Systemtic Name: (phenylmethyl) (2S,3R)-2-methyl-3-(2-nitrophenyl)-3-oxidanyl-2-(phenylmethoxycarbonylamino)propanoate Openeye Name: benzyl (2S,3R)-2-(benzyloxycarbonylamino)-3-hydroxy-2-methyl-3-(2-nitrophenyl)propanoate CAS Name: (2S,3R)-3-hydroxy-2-methyl-3-(2-nitrophenyl)-2-(phenylmethoxycarbonylamino)propanoic acid (phenylmethyl) ester IUPAC Name: benzyl (2S,3R)-3-hydroxy-2-methyl-3-(2-nitrophenyl)-2-(phenylmethoxycarbonylamino)propanoate Traditional Name: (2S,3R)-2-(benzyloxycarbonylamino)-3-hydroxy-2-methyl-3-(2-nitrophenyl)propionic acid benzyl ester Formula: C25H24N2O7 MolecularWeight: 464.46726

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C1=CC=CC=C1[N+](=O)[O-])O)(C(=O)OCC2=CC=CC=C2)NC(=O)OCC3=CC=CC=C3

Isomeric SMILES

C[C@]([C@@H](C1=CC=CC=C1[N+](=O)[O-])O)(C(=O)OCC2=CC=CC=C2)NC(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C25H24N2O7/c1-25(23(29)33-16-18-10-4-2-5-11-18,22(28)20-14-8-9-15-21(20)27(31)32)26-24(30)34-17-19-12-6-3-7-13-19/h2-15,22,28H,16-17H2,1H3,(H,26,30)/t22-,25+/m1/s1