ethyl 6-[bis(fluoranyl)methyl]-5-cyano-4-propyl-2-(trifluoromethyl)pyridine-3-carboxylate

Systemtic Name: ethyl 6-[bis(fluoranyl)methyl]-5-cyano-4-propyl-2-(trifluoromethyl)pyridine-3-carboxylate Openeye Name: ethyl 5-cyano-6-(difluoromethyl)-4-propyl-2-(trifluoromethyl)pyridine-3-carboxylate CAS Name: 5-cyano-6-(difluoromethyl)-4-propyl-2-(trifluoromethyl)-3-pyridinecarboxylic acid ethyl ester IUPAC Name: ethyl 5-cyano-6-(difluoromethyl)-4-propyl-2-(trifluoromethyl)pyridine-3-carboxylate Traditional Name: 5-cyano-6-(difluoromethyl)-4-propyl-2-(trifluoromethyl)nicotinic acid ethyl ester Formula: C14H13F5N2O2 MolecularWeight: 336.257236

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C(=NC(=C1C(=O)OCC)C(F)(F)F)C(F)F)C#N

Isomeric SMILES

CCCC1=C(C(=NC(=C1C(=O)OCC)C(F)(F)F)C(F)F)C#N

InChI

InChI=1S/C14H13F5N2O2/c1-3-5-7-8(6-20)10(12(15)16)21-11(14(17,18)19)9(7)13(22)23-4-2/h12H,3-5H2,1-2H3