1-[(4-bromophenyl)-quinolin-4-yl-methyl]pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[(4-bromophenyl)-quinolin-4-yl-methyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[(4-bromophenyl)-(4-quinolyl)methyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[(4-bromophenyl)-(4-quinolinyl)methyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[(4-bromophenyl)-quinolin-4-ylmethyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[(4-bromophenyl)-(4-quinolyl)methyl]proline Formula: C21H19BrN2O2 MolecularWeight: 411.29176

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(C2=CC=C(C=C2)Br)C3=CC=NC4=CC=CC=C34)C(=O)O

Isomeric SMILES

C1CC(N(C1)C(C2=CC=C(C=C2)Br)C3=CC=NC4=CC=CC=C34)C(=O)O

InChI

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