methyl (2S,3R,4S,5S)-4-nitro-5-phenyl-3-[(1S)-1-phenylmethoxyethyl]pyrrolidine-2-carboxylate

Systemtic Name: methyl (2S,3R,4S,5S)-4-nitro-5-phenyl-3-[(1S)-1-phenylmethoxyethyl]pyrrolidine-2-carboxylate Openeye Name: methyl (2S,3R,4S,5S)-3-[(1S)-1-benzyloxyethyl]-4-nitro-5-phenyl-pyrrolidine-2-carboxylate CAS Name: (2S,3R,4S,5S)-4-nitro-5-phenyl-3-[(1S)-1-phenylmethoxyethyl]-2-pyrrolidinecarboxylic acid methyl ester IUPAC Name: methyl (2S,3R,4S,5S)-4-nitro-5-phenyl-3-[(1S)-1-phenylmethoxyethyl]pyrrolidine-2-carboxylate Traditional Name: (2S,3R,4S,5S)-3-[(1S)-1-benzoxyethyl]-4-nitro-5-phenyl-pyrrolidine-2-carboxylic acid methyl ester Formula: C21H24N2O5 MolecularWeight: 384.42566

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1C(C(NC1C(=O)OC)C2=CC=CC=C2)[N+](=O)[O-])OCC3=CC=CC=C3

Isomeric SMILES

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

InChI

InChI=1S/C21H24N2O5/c1-14(28-13-15-9-5-3-6-10-15)17-19(21(24)27-2)22-18(20(17)23(25)26)16-11-7-4-8-12-16/h3-12,14,17-20,22H,13H2,1-2H3/t14-,17+,18-,19-,20-/m0/s1