1-[[2,3-bis(chloranyl)phenyl]-quinolin-2-yl-methyl]pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[[2,3-bis(chloranyl)phenyl]-quinolin-2-yl-methyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[(2,3-dichlorophenyl)-(2-quinolyl)methyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[(2,3-dichlorophenyl)-(2-quinolinyl)methyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[(2,3-dichlorophenyl)-quinolin-2-ylmethyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[(2,3-dichlorophenyl)-(2-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=C(C(=CC=C2)Cl)Cl)C3=NC4=CC=CC=C4C=C3)C(=O)O

Isomeric SMILES

C1CC(N(C1)C(C2=C(C(=CC=C2)Cl)Cl)C3=NC4=CC=CC=C4C=C3)C(=O)O

InChI

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