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

Systemtic Name: 1-[(3,4-dichlorophenyl)-quinolin-4-yl-methyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[(3,4-dichlorophenyl)-(4-quinolyl)methyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[(3,4-dichlorophenyl)-(4-quinolinyl)methyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[(3,4-dichlorophenyl)-quinolin-4-ylmethyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[(3,4-dichlorophenyl)-(4-quinolyl)methyl]proline Formula: C21H18Cl2N2O2 MolecularWeight: 401.28582

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H18Cl2N2O2/c22-16-8-7-13(12-17(16)23)20(25-11-3-6-19(25)21(26)27)15-9-10-24-18-5-2-1-4-14(15)18/h1-2,4-5,7-10,12,19-20H,3,6,11H2,(H,26,27)