(2S)-1-(2,6-dinitrophenyl)pyrrolidine-2-carboxylic acid

Systemtic Name: (2S)-1-(2,6-dinitrophenyl)pyrrolidine-2-carboxylic acid Openeye Name: (2S)-1-(2,6-dinitrophenyl)pyrrolidine-2-carboxylic acid CAS Name: (2S)-1-(2,6-dinitrophenyl)-2-pyrrolidinecarboxylic acid IUPAC Name: (2S)-1-(2,6-dinitrophenyl)pyrrolidine-2-carboxylic acid Traditional Name: (2S)-1-(2,6-dinitrophenyl)proline Formula: C11H11N3O6 MolecularWeight: 281.22154

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H11N3O6/c15-11(16)9-5-2-6-12(9)10-7(13(17)18)3-1-4-8(10)14(19)20/h1,3-4,9H,2,5-6H2,(H,15,16)/t9-/m0/s1