N-[1-[(2-fluoranyl-4-methoxy-phenyl)methyl]piperidin-4-yl]-4-oxidanylidene-7-(trifluoromethyloxy)-1H-quinoline-2-carboxamide

Systemtic Name: N-[1-[(2-fluoranyl-4-methoxy-phenyl)methyl]piperidin-4-yl]-4-oxidanylidene-7-(trifluoromethyloxy)-1H-quinoline-2-carboxamide Openeye Name: N-[1-[(2-fluoro-4-methoxy-phenyl)methyl]-4-piperidyl]-4-oxo-7-(trifluoromethoxy)-1H-quinoline-2-carboxamide CAS Name: N-[1-[(2-fluoro-4-methoxyphenyl)methyl]-4-piperidinyl]-4-oxo-7-(trifluoromethoxy)-1H-quinoline-2-carboxamide IUPAC Name: N-[1-[(2-fluoro-4-methoxyphenyl)methyl]piperidin-4-yl]-4-oxo-7-(trifluoromethoxy)-1H-quinoline-2-carboxamide Traditional Name: N-[1-(2-fluoro-4-methoxy-benzyl)-4-piperidyl]-4-keto-7-(trifluoromethoxy)-1H-quinoline-2-carboxamide Formula: C24H23F4N3O4 MolecularWeight: 493.450733

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)CN2CCC(CC2)NC(=O)C3=CC(=O)C4=C(N3)C=C(C=C4)OC(F)(F)F)F

Isomeric SMILES

COC1=CC(=C(C=C1)CN2CCC(CC2)NC(=O)C3=CC(=O)C4=C(N3)C=C(C=C4)OC(F)(F)F)F

InChI

InChI=1S/C24H23F4N3O4/c1-34-16-3-2-14(19(25)10-16)13-31-8-6-15(7-9-31)29-23(33)21-12-22(32)18-5-4-17(11-20(18)30-21)35-24(26,27)28/h2-5,10-12,15H,6-9,13H2,1H3,(H,29,33)(H,30,32)