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

Systemtic Name: (4-nitrophenyl)methyl (2S,4R)-4-oxidanyl-2-[(phenylmethyl)carbamoyl]pyrrolidine-1-carboxylate Openeye Name: (4-nitrophenyl)methyl (2S,4R)-2-(benzylcarbamoyl)-4-hydroxy-pyrrolidine-1-carboxylate CAS Name: (2S,4R)-4-hydroxy-2-[oxo-[(phenylmethyl)amino]methyl]-1-pyrrolidinecarboxylic acid (4-nitrophenyl)methyl ester IUPAC Name: (4-nitrophenyl)methyl (2S,4R)-2-(benzylcarbamoyl)-4-hydroxypyrrolidine-1-carboxylate Traditional Name: (2S,4R)-2-(benzylcarbamoyl)-4-hydroxy-pyrrolidine-1-carboxylic acid (4-nitrobenzyl) ester Formula: C20H21N3O6 MolecularWeight: 399.39724

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(CN(C1C(=O)NCC2=CC=CC=C2)C(=O)OCC3=CC=C(C=C3)[N+](=O)[O-])O

Isomeric SMILES

C1[C@H](CN([C@@H]1C(=O)NCC2=CC=CC=C2)C(=O)OCC3=CC=C(C=C3)[N+](=O)[O-])O

InChI

InChI=1S/C20H21N3O6/c24-17-10-18(19(25)21-11-14-4-2-1-3-5-14)22(12-17)20(26)29-13-15-6-8-16(9-7-15)23(27)28/h1-9,17-18,24H,10-13H2,(H,21,25)/t17-,18+/m1/s1