methyl (2S,3S,4R,5S)-3-(4-chlorophenyl)-5-(2-hydroxyphenyl)-4-nitro-pyrrolidine-2-carboxylate

Systemtic Name: methyl (2S,3S,4R,5S)-3-(4-chlorophenyl)-5-(2-hydroxyphenyl)-4-nitro-pyrrolidine-2-carboxylate Openeye Name: methyl (2S,3S,4R,5S)-3-(4-chlorophenyl)-5-(2-hydroxyphenyl)-4-nitro-pyrrolidine-2-carboxylate CAS Name: (2S,3S,4R,5S)-3-(4-chlorophenyl)-5-(2-hydroxyphenyl)-4-nitro-2-pyrrolidinecarboxylic acid methyl ester IUPAC Name: methyl (2S,3S,4R,5S)-3-(4-chlorophenyl)-5-(2-hydroxyphenyl)-4-nitropyrrolidine-2-carboxylate Traditional Name: (2S,3S,4R,5S)-3-(4-chlorophenyl)-5-(2-hydroxyphenyl)-4-nitro-pyrrolidine-2-carboxylic acid methyl ester Formula: C18H17ClN2O5 MolecularWeight: 376.79098

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1C(C(C(N1)C2=CC=CC=C2O)[N+](=O)[O-])C3=CC=C(C=C3)Cl

Isomeric SMILES

COC(=O)[C@@H]1[C@@H]([C@H]([C@@H](N1)C2=CC=CC=C2O)[N+](=O)[O-])C3=CC=C(C=C3)Cl

InChI

InChI=1S/C18H17ClN2O5/c1-26-18(23)16-14(10-6-8-11(19)9-7-10)17(21(24)25)15(20-16)12-4-2-3-5-13(12)22/h2-9,14-17,20,22H,1H3/t14-,15-,16-,17+/m0/s1