methyl 1-[[4-oxidanylidene-8-(trifluoromethyl)-1H-quinolin-3-yl]carbonyl]piperidine-4-carboxylate

Systemtic Name: methyl 1-[[4-oxidanylidene-8-(trifluoromethyl)-1H-quinolin-3-yl]carbonyl]piperidine-4-carboxylate Openeye Name: methyl 1-[4-oxo-8-(trifluoromethyl)-1H-quinoline-3-carbonyl]piperidine-4-carboxylate CAS Name: 1-[oxo-[4-oxo-8-(trifluoromethyl)-1H-quinolin-3-yl]methyl]-4-piperidinecarboxylic acid methyl ester IUPAC Name: methyl 1-[4-oxo-8-(trifluoromethyl)-1H-quinoline-3-carbonyl]piperidine-4-carboxylate Traditional Name: 1-[4-keto-8-(trifluoromethyl)-1H-quinoline-3-carbonyl]isonipecotic acid methyl ester Formula: C18H17F3N2O4 MolecularWeight: 382.33379

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CCN(CC1)C(=O)C2=CNC3=C(C2=O)C=CC=C3C(F)(F)F

Isomeric SMILES

COC(=O)C1CCN(CC1)C(=O)C2=CNC3=C(C2=O)C=CC=C3C(F)(F)F

InChI

InChI=1S/C18H17F3N2O4/c1-27-17(26)10-5-7-23(8-6-10)16(25)12-9-22-14-11(15(12)24)3-2-4-13(14)18(19,20)21/h2-4,9-10H,5-8H2,1H3,(H,22,24)