2-(4-methylphenyl)-3-pyrrolidin-1-yl-quinoline-4-carboxylate

Systemtic Name: 2-(4-methylphenyl)-3-pyrrolidin-1-yl-quinoline-4-carboxylate Openeye Name: 2-(p-tolyl)-3-pyrrolidin-1-yl-quinoline-4-carboxylate CAS Name: 2-(4-methylphenyl)-3-(1-pyrrolidinyl)-4-quinolinecarboxylate IUPAC Name: 2-(4-methylphenyl)-3-pyrrolidin-1-ylquinoline-4-carboxylate Traditional Name: 2-(p-tolyl)-3-pyrrolidino-cinchoninate Formula: C21H19N2O2- MolecularWeight: 331.38776

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2N4CCCC4)C(=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2N4CCCC4)C(=O)[O-]

InChI

InChI=1S/C21H20N2O2/c1-14-8-10-15(11-9-14)19-20(23-12-4-5-13-23)18(21(24)25)16-6-2-3-7-17(16)22-19/h2-3,6-11H,4-5,12-13H2,1H3,(H,24,25)/p-1