ethyl (2S,3R,4S,5S)-5-(4-chlorophenyl)-4-nitro-3-phenyl-pyrrolidine-2-carboxylate

Systemtic Name: ethyl (2S,3R,4S,5S)-5-(4-chlorophenyl)-4-nitro-3-phenyl-pyrrolidine-2-carboxylate Openeye Name: ethyl (2S,3R,4S,5S)-5-(4-chlorophenyl)-4-nitro-3-phenyl-pyrrolidine-2-carboxylate CAS Name: (2S,3R,4S,5S)-5-(4-chlorophenyl)-4-nitro-3-phenyl-2-pyrrolidinecarboxylic acid ethyl ester IUPAC Name: ethyl (2S,3R,4S,5S)-5-(4-chlorophenyl)-4-nitro-3-phenylpyrrolidine-2-carboxylate Traditional Name: (2S,3R,4S,5S)-5-(4-chlorophenyl)-4-nitro-3-phenyl-pyrrolidine-2-carboxylic acid ethyl ester Formula: C19H19ClN2O4 MolecularWeight: 374.81816

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1C(C(C(N1)C2=CC=C(C=C2)Cl)[N+](=O)[O-])C3=CC=CC=C3

Isomeric SMILES

CCOC(=O)[C@@H]1[C@H]([C@@H]([C@@H](N1)C2=CC=C(C=C2)Cl)[N+](=O)[O-])C3=CC=CC=C3

InChI

InChI=1S/C19H19ClN2O4/c1-2-26-19(23)17-15(12-6-4-3-5-7-12)18(22(24)25)16(21-17)13-8-10-14(20)11-9-13/h3-11,15-18,21H,2H2,1H3/t15-,16+,17+,18+/m1/s1