methyl (2S,4R)-1-[(2-nitrophenyl)methyl]-4-oxidanyl-pyrrolidine-2-carboxylate

Systemtic Name: methyl (2S,4R)-1-[(2-nitrophenyl)methyl]-4-oxidanyl-pyrrolidine-2-carboxylate Openeye Name: methyl (2S,4R)-4-hydroxy-1-[(2-nitrophenyl)methyl]pyrrolidine-2-carboxylate CAS Name: (2S,4R)-4-hydroxy-1-[(2-nitrophenyl)methyl]-2-pyrrolidinecarboxylic acid methyl ester IUPAC Name: methyl (2S,4R)-4-hydroxy-1-[(2-nitrophenyl)methyl]pyrrolidine-2-carboxylate Traditional Name: (2S,4R)-4-hydroxy-1-(2-nitrobenzyl)pyrrolidine-2-carboxylic acid methyl ester Formula: C13H16N2O5 MolecularWeight: 280.27654

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CC(CN1CC2=CC=CC=C2[N+](=O)[O-])O

Isomeric SMILES

COC(=O)[C@@H]1C[C@H](CN1CC2=CC=CC=C2[N+](=O)[O-])O

InChI

InChI=1S/C13H16N2O5/c1-20-13(17)12-6-10(16)8-14(12)7-9-4-2-3-5-11(9)15(18)19/h2-5,10,12,16H,6-8H2,1H3/t10-,12+/m1/s1