butoxycarbonyl 4-[3-(3-fluoranyl-6-methoxy-quinolin-4-yl)-3-oxidanylidene-propyl]piperidine-3-carboxylate

Systemtic Name: butoxycarbonyl 4-[3-(3-fluoranyl-6-methoxy-quinolin-4-yl)-3-oxidanylidene-propyl]piperidine-3-carboxylate Openeye Name: butoxycarbonyl 4-[3-(3-fluoro-6-methoxy-4-quinolyl)-3-oxo-propyl]piperidine-3-carboxylate CAS Name: 4-[3-(3-fluoro-6-methoxy-4-quinolinyl)-3-oxopropyl]-3-piperidinecarboxylic acid [butoxy(oxo)methyl] ester IUPAC Name: butoxycarbonyl 4-[3-(3-fluoro-6-methoxyquinolin-4-yl)-3-oxopropyl]piperidine-3-carboxylate Traditional Name: 4-[3-(3-fluoro-6-methoxy-4-quinolyl)-3-keto-propyl]nipecotic acid butoxycarbonyl ester Formula: C24H29FN2O6 MolecularWeight: 460.495263

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)OC(=O)C1CNCCC1CCC(=O)C2=C3C=C(C=CC3=NC=C2F)OC

Isomeric SMILES

CCCCOC(=O)OC(=O)C1CNCCC1CCC(=O)C2=C3C=C(C=CC3=NC=C2F)OC

InChI

InChI=1S/C24H29FN2O6/c1-3-4-11-32-24(30)33-23(29)18-13-26-10-9-15(18)5-8-21(28)22-17-12-16(31-2)6-7-20(17)27-14-19(22)25/h6-7,12,14-15,18,26H,3-5,8-11,13H2,1-2H3