(2R,4S)-1-(2-nitrophenyl)carbonyl-4-oxidanyl-pyrrolidine-2-carboxylic acid

Systemtic Name: (2R,4S)-1-(2-nitrophenyl)carbonyl-4-oxidanyl-pyrrolidine-2-carboxylic acid Openeye Name: (2R,4S)-4-hydroxy-1-(2-nitrobenzoyl)pyrrolidine-2-carboxylic acid CAS Name: (2R,4S)-4-hydroxy-1-[(2-nitrophenyl)-oxomethyl]-2-pyrrolidinecarboxylic acid IUPAC Name: (2R,4S)-4-hydroxy-1-(2-nitrobenzoyl)pyrrolidine-2-carboxylic acid Traditional Name: (2R,4S)-4-hydroxy-1-(2-nitrobenzoyl)proline Formula: C12H12N2O6 MolecularWeight: 280.23348

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Descriptors Computed from Structure

Canonical SMILES:

C1C(CN(C1C(=O)O)C(=O)C2=CC=CC=C2[N+](=O)[O-])O

Isomeric SMILES

C1[C@@H](CN([C@H]1C(=O)O)C(=O)C2=CC=CC=C2[N+](=O)[O-])O

InChI

InChI=1S/C12H12N2O6/c15-7-5-10(12(17)18)13(6-7)11(16)8-3-1-2-4-9(8)14(19)20/h1-4,7,10,15H,5-6H2,(H,17,18)/t7-,10+/m0/s1