4-[3-(3-fluoranyl-6-methoxy-quinolin-4-yl)-3-oxidanylidene-propyl]piperidine-3-carboxylic acid

Systemtic Name: 4-[3-(3-fluoranyl-6-methoxy-quinolin-4-yl)-3-oxidanylidene-propyl]piperidine-3-carboxylic acid Openeye Name: 4-[3-(3-fluoro-6-methoxy-4-quinolyl)-3-oxo-propyl]piperidine-3-carboxylic acid CAS Name: 4-[3-(3-fluoro-6-methoxy-4-quinolinyl)-3-oxopropyl]-3-piperidinecarboxylic acid IUPAC Name: 4-[3-(3-fluoro-6-methoxyquinolin-4-yl)-3-oxopropyl]piperidine-3-carboxylic acid Traditional Name: 4-[3-(3-fluoro-6-methoxy-4-quinolyl)-3-keto-propyl]nipecotic acid Formula: C19H21FN2O4 MolecularWeight: 360.379443

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C(=CN=C2C=C1)F)C(=O)CCC3CCNCC3C(=O)O

Isomeric SMILES

COC1=CC2=C(C(=CN=C2C=C1)F)C(=O)CCC3CCNCC3C(=O)O

InChI

InChI=1S/C19H21FN2O4/c1-26-12-3-4-16-13(8-12)18(15(20)10-22-16)17(23)5-2-11-6-7-21-9-14(11)19(24)25/h3-4,8,10-11,14,21H,2,5-7,9H2,1H3,(H,24,25)