1-[(2,5-dimethylphenyl)-quinolin-3-yl-methyl]pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[(2,5-dimethylphenyl)-quinolin-3-yl-methyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[(2,5-dimethylphenyl)-(3-quinolyl)methyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[(2,5-dimethylphenyl)-(3-quinolinyl)methyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[(2,5-dimethylphenyl)-quinolin-3-ylmethyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[(2,5-dimethylphenyl)-(3-quinolyl)methyl]proline Formula: C23H24N2O2 MolecularWeight: 360.44886

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)C(C2=CC3=CC=CC=C3N=C2)N4CCCC4C(=O)O

Isomeric SMILES

CC1=CC(=C(C=C1)C)C(C2=CC3=CC=CC=C3N=C2)N4CCCC4C(=O)O

InChI

InChI=1S/C23H24N2O2/c1-15-9-10-16(2)19(12-15)22(25-11-5-8-21(25)23(26)27)18-13-17-6-3-4-7-20(17)24-14-18/h3-4,6-7,9-10,12-14,21-22H,5,8,11H2,1-2H3,(H,26,27)