1-(4-aminocarbonyl-2-nitro-phenyl)pyrrolidine-2-carboxylic acid

Systemtic Name: 1-(4-aminocarbonyl-2-nitro-phenyl)pyrrolidine-2-carboxylic acid Openeye Name: 1-(4-carbamoyl-2-nitro-phenyl)pyrrolidine-2-carboxylic acid CAS Name: 1-(4-carbamoyl-2-nitrophenyl)-2-pyrrolidinecarboxylic acid IUPAC Name: 1-(4-carbamoyl-2-nitrophenyl)pyrrolidine-2-carboxylic acid Traditional Name: 1-(4-carbamoyl-2-nitro-phenyl)proline Formula: C12H13N3O5 MolecularWeight: 279.24872

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H13N3O5/c13-11(16)7-3-4-8(10(6-7)15(19)20)14-5-1-2-9(14)12(17)18/h3-4,6,9H,1-2,5H2,(H2,13,16)(H,17,18)