dimethyl (2S,3R,4S,5R)-3-(2-chloranyl-7-methoxy-quinolin-3-yl)-5-phenyl-pyrrolidine-2,4-dicarboxylate

Systemtic Name: dimethyl (2S,3R,4S,5R)-3-(2-chloranyl-7-methoxy-quinolin-3-yl)-5-phenyl-pyrrolidine-2,4-dicarboxylate Openeye Name: dimethyl (2S,3R,4S,5R)-3-(2-chloro-7-methoxy-3-quinolyl)-5-phenyl-pyrrolidine-2,4-dicarboxylate CAS Name: (2S,3R,4S,5R)-3-(2-chloro-7-methoxy-3-quinolinyl)-5-phenylpyrrolidine-2,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl (2S,3R,4S,5R)-3-(2-chloro-7-methoxyquinolin-3-yl)-5-phenylpyrrolidine-2,4-dicarboxylate Traditional Name: (2S,3R,4S,5R)-3-(2-chloro-7-methoxy-3-quinolyl)-5-phenyl-pyrrolidine-2,4-dicarboxylic acid dimethyl ester Formula: C24H23ClN2O5 MolecularWeight: 454.90282

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=NC(=C(C=C2C=C1)C3C(C(NC3C(=O)OC)C4=CC=CC=C4)C(=O)OC)Cl

Isomeric SMILES

COC1=CC2=NC(=C(C=C2C=C1)[C@H]3[C@@H]([C@@H](N[C@@H]3C(=O)OC)C4=CC=CC=C4)C(=O)OC)Cl

InChI

InChI=1S/C24H23ClN2O5/c1-30-15-10-9-14-11-16(22(25)26-17(14)12-15)18-19(23(28)31-2)20(13-7-5-4-6-8-13)27-21(18)24(29)32-3/h4-12,18-21,27H,1-3H3/t18-,19-,20-,21-/m0/s1