(2R)-1-(2-cyano-4-nitro-phenyl)pyrrolidine-2-carboxylic acid

Systemtic Name: (2R)-1-(2-cyano-4-nitro-phenyl)pyrrolidine-2-carboxylic acid Openeye Name: (2R)-1-(2-cyano-4-nitro-phenyl)pyrrolidine-2-carboxylic acid CAS Name: (2R)-1-(2-cyano-4-nitrophenyl)-2-pyrrolidinecarboxylic acid IUPAC Name: (2R)-1-(2-cyano-4-nitrophenyl)pyrrolidine-2-carboxylic acid Traditional Name: (2R)-1-(2-cyano-4-nitro-phenyl)proline Formula: C12H11N3O4 MolecularWeight: 261.23344

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C2=C(C=C(C=C2)[N+](=O)[O-])C#N)C(=O)O

Isomeric SMILES

C1C[C@@H](N(C1)C2=C(C=C(C=C2)[N+](=O)[O-])C#N)C(=O)O

InChI

InChI=1S/C12H11N3O4/c13-7-8-6-9(15(18)19)3-4-10(8)14-5-1-2-11(14)12(16)17/h3-4,6,11H,1-2,5H2,(H,16,17)/t11-/m1/s1