dimethyl (2R,5R)-2-(4-chlorophenyl)-5-phenyl-1-(phenylmethyl)pyrrolidine-3,3-dicarboxylate

Systemtic Name: dimethyl (2R,5R)-2-(4-chlorophenyl)-5-phenyl-1-(phenylmethyl)pyrrolidine-3,3-dicarboxylate Openeye Name: dimethyl (2R,5R)-1-benzyl-2-(4-chlorophenyl)-5-phenyl-pyrrolidine-3,3-dicarboxylate CAS Name: (2R,5R)-2-(4-chlorophenyl)-5-phenyl-1-(phenylmethyl)pyrrolidine-3,3-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl (2R,5R)-1-benzyl-2-(4-chlorophenyl)-5-phenylpyrrolidine-3,3-dicarboxylate Traditional Name: (2R,5R)-1-benzyl-2-(4-chlorophenyl)-5-phenyl-pyrrolidine-3,3-dicarboxylic acid dimethyl ester Formula: C27H26ClNO4 MolecularWeight: 463.95264

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1(CC(N(C1C2=CC=C(C=C2)Cl)CC3=CC=CC=C3)C4=CC=CC=C4)C(=O)OC

Isomeric SMILES

COC(=O)C1(C[C@@H](N([C@@H]1C2=CC=C(C=C2)Cl)CC3=CC=CC=C3)C4=CC=CC=C4)C(=O)OC

InChI

InChI=1S/C27H26ClNO4/c1-32-25(30)27(26(31)33-2)17-23(20-11-7-4-8-12-20)29(18-19-9-5-3-6-10-19)24(27)21-13-15-22(28)16-14-21/h3-16,23-24H,17-18H2,1-2H3/t23-,24-/m1/s1