3-(3-nitrophenyl)-3-oxidanyl-2-(2-phenylethanoylamino)propanoic acid

Systemtic Name: 3-(3-nitrophenyl)-3-oxidanyl-2-(2-phenylethanoylamino)propanoic acid Openeye Name: 3-hydroxy-3-(3-nitrophenyl)-2-[(2-phenylacetyl)amino]propanoic acid CAS Name: 3-hydroxy-3-(3-nitrophenyl)-2-[(1-oxo-2-phenylethyl)amino]propanoic acid IUPAC Name: 3-hydroxy-3-(3-nitrophenyl)-2-[(2-phenylacetyl)amino]propanoic acid Traditional Name: 3-hydroxy-3-(3-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(=CC=C2)[N+](=O)[O-])O)C(=O)O

Isomeric SMILES

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

InChI

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