(4-nitrophenyl)methyl (2S,4R)-2-[(3S)-1-methylpyrrolidin-3-yl]-4-oxidanyl-pyrrolidine-1-carboxylate

Systemtic Name: (4-nitrophenyl)methyl (2S,4R)-2-[(3S)-1-methylpyrrolidin-3-yl]-4-oxidanyl-pyrrolidine-1-carboxylate Openeye Name: (4-nitrophenyl)methyl (2S,4R)-4-hydroxy-2-[(3S)-1-methylpyrrolidin-3-yl]pyrrolidine-1-carboxylate CAS Name: (2S,4R)-4-hydroxy-2-[(3S)-1-methyl-3-pyrrolidinyl]-1-pyrrolidinecarboxylic acid (4-nitrophenyl)methyl ester IUPAC Name: (4-nitrophenyl)methyl (2S,4R)-4-hydroxy-2-[(3S)-1-methylpyrrolidin-3-yl]pyrrolidine-1-carboxylate Traditional Name: (2S,4R)-4-hydroxy-2-[(3S)-1-methylpyrrolidin-3-yl]pyrrolidine-1-carboxylic acid (4-nitrobenzyl) ester Formula: C17H23N3O5 MolecularWeight: 349.38162

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCC(C1)C2CC(CN2C(=O)OCC3=CC=C(C=C3)[N+](=O)[O-])O

Isomeric SMILES

CN1CC[C@@H](C1)[C@@H]2C[C@H](CN2C(=O)OCC3=CC=C(C=C3)[N+](=O)[O-])O

InChI

InChI=1S/C17H23N3O5/c1-18-7-6-13(9-18)16-8-15(21)10-19(16)17(22)25-11-12-2-4-14(5-3-12)20(23)24/h2-5,13,15-16,21H,6-11H2,1H3/t13-,15+,16-/m0/s1