[2-[5-cyano-1-(2-methoxyethyl)-6-oxidanylidene-pyridin-3-yl]carbonylphenyl] 3-(trifluoromethyl)benzoate

Systemtic Name: [2-[5-cyano-1-(2-methoxyethyl)-6-oxidanylidene-pyridin-3-yl]carbonylphenyl] 3-(trifluoromethyl)benzoate Openeye Name: [2-[5-cyano-1-(2-methoxyethyl)-6-oxo-pyridine-3-carbonyl]phenyl] 3-(trifluoromethyl)benzoate CAS Name: 3-(trifluoromethyl)benzoic acid [2-[[5-cyano-1-(2-methoxyethyl)-6-oxo-3-pyridinyl]-oxomethyl]phenyl] ester IUPAC Name: [2-[5-cyano-1-(2-methoxyethyl)-6-oxopyridine-3-carbonyl]phenyl] 3-(trifluoromethyl)benzoate Traditional Name: 3-(trifluoromethyl)benzoic acid [2-[5-cyano-6-keto-1-(2-methoxyethyl)nicotinoyl]phenyl] ester Formula: C24H17F3N2O5 MolecularWeight: 470.39739

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COCCN1C=C(C=C(C1=O)C#N)C(=O)C2=CC=CC=C2OC(=O)C3=CC(=CC=C3)C(F)(F)F

Isomeric SMILES

COCCN1C=C(C=C(C1=O)C#N)C(=O)C2=CC=CC=C2OC(=O)C3=CC(=CC=C3)C(F)(F)F

InChI

InChI=1S/C24H17F3N2O5/c1-33-10-9-29-14-17(11-16(13-28)22(29)31)21(30)19-7-2-3-8-20(19)34-23(32)15-5-4-6-18(12-15)24(25,26)27/h2-8,11-12,14H,9-10H2,1H3