4-(2-methyl-4-pyrrolidin-1-yl-quinolin-7-yl)benzoic acid

Systemtic Name: 4-(2-methyl-4-pyrrolidin-1-yl-quinolin-7-yl)benzoic acid Openeye Name: 4-(2-methyl-4-pyrrolidin-1-yl-7-quinolyl)benzoic acid CAS Name: 4-[2-methyl-4-(1-pyrrolidinyl)-7-quinolinyl]benzoic acid IUPAC Name: 4-(2-methyl-4-pyrrolidin-1-ylquinolin-7-yl)benzoic acid Traditional Name: 4-(2-methyl-4-pyrrolidino-7-quinolyl)benzoic acid Formula: C21H20N2O2 MolecularWeight: 332.3957

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=CC(=C2)C3=CC=C(C=C3)C(=O)O)C(=C1)N4CCCC4

Isomeric SMILES

CC1=NC2=C(C=CC(=C2)C3=CC=C(C=C3)C(=O)O)C(=C1)N4CCCC4

InChI

InChI=1S/C21H20N2O2/c1-14-12-20(23-10-2-3-11-23)18-9-8-17(13-19(18)22-14)15-4-6-16(7-5-15)21(24)25/h4-9,12-13H,2-3,10-11H2,1H3,(H,24,25)