(2R,4S)-4-methoxy-1-[(5-nitro-1H-pyrrol-2-yl)carbonyl]pyrrolidine-2-carboxylate

Systemtic Name: (2R,4S)-4-methoxy-1-[(5-nitro-1H-pyrrol-2-yl)carbonyl]pyrrolidine-2-carboxylate Openeye Name: (2R,4S)-4-methoxy-1-(5-nitro-1H-pyrrole-2-carbonyl)pyrrolidine-2-carboxylate CAS Name: (2R,4S)-4-methoxy-1-[(5-nitro-1H-pyrrol-2-yl)-oxomethyl]-2-pyrrolidinecarboxylate IUPAC Name: (2R,4S)-4-methoxy-1-(5-nitro-1H-pyrrole-2-carbonyl)pyrrolidine-2-carboxylate Traditional Name: (2R,4S)-4-methoxy-1-(5-nitro-1H-pyrrole-2-carbonyl)pyrrolidine-2-carboxylate Formula: C11H12N3O6- MolecularWeight: 282.22948

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Descriptors Computed from Structure

Canonical SMILES:

COC1CC(N(C1)C(=O)C2=CC=C(N2)[N+](=O)[O-])C(=O)[O-]

Isomeric SMILES

CO[C@H]1C[C@@H](N(C1)C(=O)C2=CC=C(N2)[N+](=O)[O-])C(=O)[O-]

InChI

InChI=1S/C11H13N3O6/c1-20-6-4-8(11(16)17)13(5-6)10(15)7-2-3-9(12-7)14(18)19/h2-3,6,8,12H,4-5H2,1H3,(H,16,17)/p-1/t6-,8+/m0/s1