(2R,4S)-4-methoxy-1-(2-nitrophenyl)carbonyl-pyrrolidine-2-carboxylate

Systemtic Name: (2R,4S)-4-methoxy-1-(2-nitrophenyl)carbonyl-pyrrolidine-2-carboxylate Openeye Name: (2R,4S)-4-methoxy-1-(2-nitrobenzoyl)pyrrolidine-2-carboxylate CAS Name: (2R,4S)-4-methoxy-1-[(2-nitrophenyl)-oxomethyl]-2-pyrrolidinecarboxylate IUPAC Name: (2R,4S)-4-methoxy-1-(2-nitrobenzoyl)pyrrolidine-2-carboxylate Traditional Name: (2R,4S)-4-methoxy-1-(2-nitrobenzoyl)pyrrolidine-2-carboxylate Formula: C13H13N2O6- MolecularWeight: 293.25212

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Descriptors Computed from Structure

Canonical SMILES:

COC1CC(N(C1)C(=O)C2=CC=CC=C2[N+](=O)[O-])C(=O)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C13H14N2O6/c1-21-8-6-11(13(17)18)14(7-8)12(16)9-4-2-3-5-10(9)15(19)20/h2-5,8,11H,6-7H2,1H3,(H,17,18)/p-1/t8-,11+/m0/s1