4-[3-(3-chloranyl-6-methoxy-quinolin-4-yl)propyl]-1-(3-pyridin-2-ylpropyl)piperidine-4-carboxylic acid

Systemtic Name: 4-[3-(3-chloranyl-6-methoxy-quinolin-4-yl)propyl]-1-(3-pyridin-2-ylpropyl)piperidine-4-carboxylic acid Openeye Name: 4-[3-(3-chloro-6-methoxy-4-quinolyl)propyl]-1-[3-(2-pyridyl)propyl]piperidine-4-carboxylic acid CAS Name: 4-[3-(3-chloro-6-methoxy-4-quinolinyl)propyl]-1-[3-(2-pyridinyl)propyl]-4-piperidinecarboxylic acid IUPAC Name: 4-[3-(3-chloro-6-methoxyquinolin-4-yl)propyl]-1-(3-pyridin-2-ylpropyl)piperidine-4-carboxylic acid Traditional Name: 4-[3-(3-chloro-6-methoxy-4-quinolyl)propyl]-1-[3-(2-pyridyl)propyl]isonipecotic acid Formula: C27H32ClN3O3 MolecularWeight: 482.01428

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C(=CN=C2C=C1)Cl)CCCC3(CCN(CC3)CCCC4=CC=CC=N4)C(=O)O

Isomeric SMILES

COC1=CC2=C(C(=CN=C2C=C1)Cl)CCCC3(CCN(CC3)CCCC4=CC=CC=N4)C(=O)O

InChI

InChI=1S/C27H32ClN3O3/c1-34-21-9-10-25-23(18-21)22(24(28)19-30-25)8-4-11-27(26(32)33)12-16-31(17-13-27)15-5-7-20-6-2-3-14-29-20/h2-3,6,9-10,14,18-19H,4-5,7-8,11-13,15-17H2,1H3,(H,32,33)