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

Systemtic Name: methyl (3R,4R)-4-[3-(3-fluoranyl-6-methoxy-quinolin-4-yl)-3-oxidanylidene-propyl]piperidine-3-carboxylate Openeye Name: methyl (3R,4R)-4-[3-(3-fluoro-6-methoxy-4-quinolyl)-3-oxo-propyl]piperidine-3-carboxylate CAS Name: (3R,4R)-4-[3-(3-fluoro-6-methoxy-4-quinolinyl)-3-oxopropyl]-3-piperidinecarboxylic acid methyl ester IUPAC Name: methyl (3R,4R)-4-[3-(3-fluoro-6-methoxyquinolin-4-yl)-3-oxopropyl]piperidine-3-carboxylate Traditional Name: (3R,4R)-4-[3-(3-fluoro-6-methoxy-4-quinolyl)-3-keto-propyl]nipecotic acid methyl ester Formula: C20H23FN2O4 MolecularWeight: 374.406023

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

COC1=CC2=C(C(=CN=C2C=C1)F)C(=O)CC[C@@H]3CCNC[C@@H]3C(=O)OC

InChI

InChI=1S/C20H23FN2O4/c1-26-13-4-5-17-14(9-13)19(16(21)11-23-17)18(24)6-3-12-7-8-22-10-15(12)20(25)27-2/h4-5,9,11-12,15,22H,3,6-8,10H2,1-2H3/t12-,15+/m1/s1