dimethyl 2-[bis(fluoranyl)methyl]-4-(2-cyclopropylethyl)-6-(trifluoromethyl)pyridine-3,5-dicarboxylate

Systemtic Name: dimethyl 2-[bis(fluoranyl)methyl]-4-(2-cyclopropylethyl)-6-(trifluoromethyl)pyridine-3,5-dicarboxylate Openeye Name: dimethyl 4-(2-cyclopropylethyl)-2-(difluoromethyl)-6-(trifluoromethyl)pyridine-3,5-dicarboxylate CAS Name: 4-(2-cyclopropylethyl)-2-(difluoromethyl)-6-(trifluoromethyl)pyridine-3,5-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 4-(2-cyclopropylethyl)-2-(difluoromethyl)-6-(trifluoromethyl)pyridine-3,5-dicarboxylate Traditional Name: 4-(2-cyclopropylethyl)-2-(difluoromethyl)-6-(trifluoromethyl)pyridine-3,5-dicarboxylic acid dimethyl ester Formula: C16H16F5NO4 MolecularWeight: 381.294556

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C(=C(N=C1C(F)F)C(F)(F)F)C(=O)OC)CCC2CC2

Isomeric SMILES

COC(=O)C1=C(C(=C(N=C1C(F)F)C(F)(F)F)C(=O)OC)CCC2CC2

InChI

InChI=1S/C16H16F5NO4/c1-25-14(23)9-8(6-5-7-3-4-7)10(15(24)26-2)12(16(19,20)21)22-11(9)13(17)18/h7,13H,3-6H2,1-2H3