1-[(2-chloranyl-5-nitro-phenyl)methyl]pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[(2-chloranyl-5-nitro-phenyl)methyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[(2-chloro-5-nitro-phenyl)methyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[(2-chloro-5-nitrophenyl)methyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[(2-chloro-5-nitrophenyl)methyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-(2-chloro-5-nitro-benzyl)proline Formula: C12H13ClN2O4 MolecularWeight: 284.69562

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)CC2=C(C=CC(=C2)[N+](=O)[O-])Cl)C(=O)O

Isomeric SMILES

C1CC(N(C1)CC2=C(C=CC(=C2)[N+](=O)[O-])Cl)C(=O)O

InChI

InChI=1S/C12H13ClN2O4/c13-10-4-3-9(15(18)19)6-8(10)7-14-5-1-2-11(14)12(16)17/h3-4,6,11H,1-2,5,7H2,(H,16,17)