(2R,3S)-3-(4-nitrophenyl)-3-oxidanyl-2-(2-phenylethanoylamino)propanoic acid

Systemtic Name: (2R,3S)-3-(4-nitrophenyl)-3-oxidanyl-2-(2-phenylethanoylamino)propanoic acid Openeye Name: (2R,3S)-3-hydroxy-3-(4-nitrophenyl)-2-[(2-phenylacetyl)amino]propanoic acid CAS Name: (2R,3S)-3-hydroxy-3-(4-nitrophenyl)-2-[(1-oxo-2-phenylethyl)amino]propanoic acid IUPAC Name: (2R,3S)-3-hydroxy-3-(4-nitrophenyl)-2-[(2-phenylacetyl)amino]propanoic acid Traditional Name: (2R,3S)-3-hydroxy-3-(4-nitrophenyl)-2-[(2-phenylacetyl)amino]propionic acid Formula: C17H16N2O6 MolecularWeight: 344.31874

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C1=CC=C(C=C1)CC(=O)N[C@H]([C@H](C2=CC=C(C=C2)[N+](=O)[O-])O)C(=O)O

InChI

InChI=1S/C17H16N2O6/c20-14(10-11-4-2-1-3-5-11)18-15(17(22)23)16(21)12-6-8-13(9-7-12)19(24)25/h1-9,15-16,21H,10H2,(H,18,20)(H,22,23)/t15-,16+/m1/s1