dimethyl (2S,4S,5R)-5-(4-bromophenyl)pyrrolidine-2,4-dicarboxylate

Systemtic Name: dimethyl (2S,4S,5R)-5-(4-bromophenyl)pyrrolidine-2,4-dicarboxylate Openeye Name: dimethyl (2S,4S,5R)-5-(4-bromophenyl)pyrrolidine-2,4-dicarboxylate CAS Name: (2S,4S,5R)-5-(4-bromophenyl)pyrrolidine-2,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl (2S,4S,5R)-5-(4-bromophenyl)pyrrolidine-2,4-dicarboxylate Traditional Name: (2S,4S,5R)-5-(4-bromophenyl)pyrrolidine-2,4-dicarboxylic acid dimethyl ester Formula: C14H16BrNO4 MolecularWeight: 342.18514

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CC(NC1C2=CC=C(C=C2)Br)C(=O)OC

Isomeric SMILES

COC(=O)[C@H]1C[C@H](N[C@H]1C2=CC=C(C=C2)Br)C(=O)OC

InChI

InChI=1S/C14H16BrNO4/c1-19-13(17)10-7-11(14(18)20-2)16-12(10)8-3-5-9(15)6-4-8/h3-6,10-12,16H,7H2,1-2H3/t10-,11-,12-/m0/s1