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

Systemtic Name: (4-nitrophenyl)methyl (2S,4R)-4-oxidanyl-2-(phenylcarbamoyl)pyrrolidine-1-carboxylate Openeye Name: (4-nitrophenyl)methyl (2S,4R)-4-hydroxy-2-(phenylcarbamoyl)pyrrolidine-1-carboxylate CAS Name: (2S,4R)-2-[anilino(oxo)methyl]-4-hydroxy-1-pyrrolidinecarboxylic acid (4-nitrophenyl)methyl ester IUPAC Name: (4-nitrophenyl)methyl (2S,4R)-4-hydroxy-2-(phenylcarbamoyl)pyrrolidine-1-carboxylate Traditional Name: (2S,4R)-4-hydroxy-2-(phenylcarbamoyl)pyrrolidine-1-carboxylic acid (4-nitrobenzyl) ester Formula: C19H19N3O6 MolecularWeight: 385.37066

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Descriptors Computed from Structure

Canonical SMILES:

C1C(CN(C1C(=O)NC2=CC=CC=C2)C(=O)OCC3=CC=C(C=C3)[N+](=O)[O-])O

Isomeric SMILES

C1[C@H](CN([C@@H]1C(=O)NC2=CC=CC=C2)C(=O)OCC3=CC=C(C=C3)[N+](=O)[O-])O

InChI

InChI=1S/C19H19N3O6/c23-16-10-17(18(24)20-14-4-2-1-3-5-14)21(11-16)19(25)28-12-13-6-8-15(9-7-13)22(26)27/h1-9,16-17,23H,10-12H2,(H,20,24)/t16-,17+/m1/s1