(4-nitrophenyl)methyl (2R,4R)-2-[3-(methylamino)-3-oxidanylidene-propyl]-4-oxidanyl-pyrrolidine-1-carboxylate

Systemtic Name: (4-nitrophenyl)methyl (2R,4R)-2-[3-(methylamino)-3-oxidanylidene-propyl]-4-oxidanyl-pyrrolidine-1-carboxylate Openeye Name: (4-nitrophenyl)methyl (2R,4R)-4-hydroxy-2-[3-(methylamino)-3-oxo-propyl]pyrrolidine-1-carboxylate CAS Name: (2R,4R)-4-hydroxy-2-[3-(methylamino)-3-oxopropyl]-1-pyrrolidinecarboxylic acid (4-nitrophenyl)methyl ester IUPAC Name: (4-nitrophenyl)methyl (2R,4R)-4-hydroxy-2-[3-(methylamino)-3-oxopropyl]pyrrolidine-1-carboxylate Traditional Name: (2R,4R)-4-hydroxy-2-[3-keto-3-(methylamino)propyl]pyrrolidine-1-carboxylic acid (4-nitrobenzyl) ester Formula: C16H21N3O6 MolecularWeight: 351.35444

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)CCC1CC(CN1C(=O)OCC2=CC=C(C=C2)[N+](=O)[O-])O

Isomeric SMILES

CNC(=O)CC[C@@H]1C[C@H](CN1C(=O)OCC2=CC=C(C=C2)[N+](=O)[O-])O

InChI

InChI=1S/C16H21N3O6/c1-17-15(21)7-6-13-8-14(20)9-18(13)16(22)25-10-11-2-4-12(5-3-11)19(23)24/h2-5,13-14,20H,6-10H2,1H3,(H,17,21)/t13-,14-/m1/s1