ethyl (2R,3S)-2-(4-nitrophenyl)-5-oxidanylidene-1-(phenylmethyl)pyrrolidine-3-carboxylate

Systemtic Name: ethyl (2R,3S)-2-(4-nitrophenyl)-5-oxidanylidene-1-(phenylmethyl)pyrrolidine-3-carboxylate Openeye Name: ethyl (2R,3S)-1-benzyl-2-(4-nitrophenyl)-5-oxo-pyrrolidine-3-carboxylate CAS Name: (2R,3S)-2-(4-nitrophenyl)-5-oxo-1-(phenylmethyl)-3-pyrrolidinecarboxylic acid ethyl ester IUPAC Name: ethyl (2R,3S)-1-benzyl-2-(4-nitrophenyl)-5-oxopyrrolidine-3-carboxylate Traditional Name: (2R,3S)-1-benzyl-5-keto-2-(4-nitrophenyl)pyrrolidine-3-carboxylic acid ethyl ester Formula: C20H20N2O5 MolecularWeight: 368.3832

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CC(=O)N(C1C2=CC=C(C=C2)[N+](=O)[O-])CC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)[C@H]1CC(=O)N([C@H]1C2=CC=C(C=C2)[N+](=O)[O-])CC3=CC=CC=C3

InChI

InChI=1S/C20H20N2O5/c1-2-27-20(24)17-12-18(23)21(13-14-6-4-3-5-7-14)19(17)15-8-10-16(11-9-15)22(25)26/h3-11,17,19H,2,12-13H2,1H3/t17-,19-/m0/s1