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

Systemtic Name: 1-[(2,4-dichlorophenyl)-quinolin-3-yl-methyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[(2,4-dichlorophenyl)-(3-quinolyl)methyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[(2,4-dichlorophenyl)-(3-quinolinyl)methyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[(2,4-dichlorophenyl)-quinolin-3-ylmethyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[(2,4-dichlorophenyl)-(3-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=C(C=C2)Cl)Cl)C3=CC4=CC=CC=C4N=C3)C(=O)O

Isomeric SMILES

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

InChI

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