1-[(4-bromophenyl)-quinolin-3-yl-methyl]pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[(4-bromophenyl)-quinolin-3-yl-methyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[(4-bromophenyl)-(3-quinolyl)methyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[(4-bromophenyl)-(3-quinolinyl)methyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[(4-bromophenyl)-quinolin-3-ylmethyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[(4-bromophenyl)-(3-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=CC4=CC=CC=C4N=C3)C(=O)O

Isomeric SMILES

C1CC(N(C1)C(C2=CC=C(C=C2)Br)C3=CC4=CC=CC=C4N=C3)C(=O)O

InChI

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