[2-methyl-1-[4-oxidanylidene-3-(pyridin-2-ylcarbamoyl)-8-(trifluoromethyl)-1H-quinolin-2-yl]propyl] ethanoate

Systemtic Name: [2-methyl-1-[4-oxidanylidene-3-(pyridin-2-ylcarbamoyl)-8-(trifluoromethyl)-1H-quinolin-2-yl]propyl] ethanoate Openeye Name: [2-methyl-1-[4-oxo-3-(2-pyridylcarbamoyl)-8-(trifluoromethyl)-1H-quinolin-2-yl]propyl] acetate CAS Name: acetic acid [2-methyl-1-[4-oxo-3-[oxo-(2-pyridinylamino)methyl]-8-(trifluoromethyl)-1H-quinolin-2-yl]propyl] ester IUPAC Name: [2-methyl-1-[4-oxo-3-(pyridin-2-ylcarbamoyl)-8-(trifluoromethyl)-1H-quinolin-2-yl]propyl] acetate Traditional Name: acetic acid [1-[4-keto-3-(2-pyridylcarbamoyl)-8-(trifluoromethyl)-1H-quinolin-2-yl]-2-methyl-propyl] ester Formula: C22H20F3N3O4 MolecularWeight: 447.40711

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C1=C(C(=O)C2=C(N1)C(=CC=C2)C(F)(F)F)C(=O)NC3=CC=CC=N3)OC(=O)C

Isomeric SMILES

CC(C)C(C1=C(C(=O)C2=C(N1)C(=CC=C2)C(F)(F)F)C(=O)NC3=CC=CC=N3)OC(=O)C

InChI

InChI=1S/C22H20F3N3O4/c1-11(2)20(32-12(3)29)18-16(21(31)27-15-9-4-5-10-26-15)19(30)13-7-6-8-14(17(13)28-18)22(23,24)25/h4-11,20H,1-3H3,(H,28,30)(H,26,27,31)