3-(2-methyl-4-pyrrolidin-1-yl-quinolin-7-yl)benzoic acid

Systemtic Name: 3-(2-methyl-4-pyrrolidin-1-yl-quinolin-7-yl)benzoic acid Openeye Name: 3-(2-methyl-4-pyrrolidin-1-yl-7-quinolyl)benzoic acid CAS Name: 3-[2-methyl-4-(1-pyrrolidinyl)-7-quinolinyl]benzoic acid IUPAC Name: 3-(2-methyl-4-pyrrolidin-1-ylquinolin-7-yl)benzoic acid Traditional Name: 3-(2-methyl-4-pyrrolidino-7-quinolyl)benzoic acid Formula: C21H20N2O2 MolecularWeight: 332.3957

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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