1-[(2-bromophenyl)-quinolin-2-yl-methyl]pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[(2-bromophenyl)-quinolin-2-yl-methyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[(2-bromophenyl)-(2-quinolyl)methyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[(2-bromophenyl)-(2-quinolinyl)methyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[(2-bromophenyl)-quinolin-2-ylmethyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[(2-bromophenyl)-(2-quinolyl)methyl]proline Formula: C21H19BrN2O2 MolecularWeight: 411.29176

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(C2=NC3=CC=CC=C3C=C2)C4=CC=CC=C4Br)C(=O)O

Isomeric SMILES

C1CC(N(C1)C(C2=NC3=CC=CC=C3C=C2)C4=CC=CC=C4Br)C(=O)O

InChI

InChI=1S/C21H19BrN2O2/c22-16-8-3-2-7-15(16)20(24-13-5-10-19(24)21(25)26)18-12-11-14-6-1-4-9-17(14)23-18/h1-4,6-9,11-12,19-20H,5,10,13H2,(H,25,26)