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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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