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

Systemtic Name: 1-(4-aminocarbonyl-2-nitro-phenyl)-4-oxidanyl-pyrrolidine-2-carboxylic acid Openeye Name: 1-(4-carbamoyl-2-nitro-phenyl)-4-hydroxy-pyrrolidine-2-carboxylic acid CAS Name: 1-(4-carbamoyl-2-nitrophenyl)-4-hydroxy-2-pyrrolidinecarboxylic acid IUPAC Name: 1-(4-carbamoyl-2-nitrophenyl)-4-hydroxypyrrolidine-2-carboxylic acid Traditional Name: 1-(4-carbamoyl-2-nitro-phenyl)-4-hydroxy-proline Formula: C12H13N3O6 MolecularWeight: 295.24812

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(CN(C1C(=O)O)C2=C(C=C(C=C2)C(=O)N)[N+](=O)[O-])O

Isomeric SMILES

C1C(CN(C1C(=O)O)C2=C(C=C(C=C2)C(=O)N)[N+](=O)[O-])O

InChI

InChI=1S/C12H13N3O6/c13-11(17)6-1-2-8(9(3-6)15(20)21)14-5-7(16)4-10(14)12(18)19/h1-3,7,10,16H,4-5H2,(H2,13,17)(H,18,19)