2-[2-(1-butyl-5-cyano-6-oxidanylidene-pyridin-3-yl)carbonyl-4-fluoranyl-phenoxy]-N-(2,4,6-trimethylphenyl)ethanamide

Systemtic Name: 2-[2-(1-butyl-5-cyano-6-oxidanylidene-pyridin-3-yl)carbonyl-4-fluoranyl-phenoxy]-N-(2,4,6-trimethylphenyl)ethanamide Openeye Name: 2-[2-(1-butyl-5-cyano-6-oxo-pyridine-3-carbonyl)-4-fluoro-phenoxy]-N-(2,4,6-trimethylphenyl)acetamide CAS Name: 2-[2-[(1-butyl-5-cyano-6-oxo-3-pyridinyl)-oxomethyl]-4-fluorophenoxy]-N-(2,4,6-trimethylphenyl)acetamide IUPAC Name: 2-[2-(1-butyl-5-cyano-6-oxopyridine-3-carbonyl)-4-fluorophenoxy]-N-(2,4,6-trimethylphenyl)acetamide Traditional Name: 2-[2-(1-butyl-5-cyano-6-keto-nicotinoyl)-4-fluoro-phenoxy]-N-mesityl-acetamide Formula: C28H28FN3O4 MolecularWeight: 489.538023

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C=C(C=C(C1=O)C#N)C(=O)C2=C(C=CC(=C2)F)OCC(=O)NC3=C(C=C(C=C3C)C)C

Isomeric SMILES

CCCCN1C=C(C=C(C1=O)C#N)C(=O)C2=C(C=CC(=C2)F)OCC(=O)NC3=C(C=C(C=C3C)C)C

InChI

InChI=1S/C28H28FN3O4/c1-5-6-9-32-15-21(12-20(14-30)28(32)35)27(34)23-13-22(29)7-8-24(23)36-16-25(33)31-26-18(3)10-17(2)11-19(26)4/h7-8,10-13,15H,5-6,9,16H2,1-4H3,(H,31,33)