5-[2-(trifluoromethyl)pyridin-3-yl]oxycarbonyl-1,4-dihydropyridine-3-carboxylate

Systemtic Name: 5-[2-(trifluoromethyl)pyridin-3-yl]oxycarbonyl-1,4-dihydropyridine-3-carboxylate Openeye Name: 5-[[2-(trifluoromethyl)-3-pyridyl]oxycarbonyl]-1,4-dihydropyridine-3-carboxylate CAS Name: 5-[oxo-[[2-(trifluoromethyl)-3-pyridinyl]oxy]methyl]-1,4-dihydropyridine-3-carboxylate IUPAC Name: 5-[2-(trifluoromethyl)pyridin-3-yl]oxycarbonyl-1,4-dihydropyridine-3-carboxylate Traditional Name: 5-[[2-(trifluoromethyl)-3-pyridyl]oxycarbonyl]-1,4-dihydropyridine-3-carboxylate Formula: C13H8F3N2O4- MolecularWeight: 313.20883

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=CNC=C1C(=O)OC2=C(N=CC=C2)C(F)(F)F)C(=O)[O-]

Isomeric SMILES

C1C(=CNC=C1C(=O)OC2=C(N=CC=C2)C(F)(F)F)C(=O)[O-]

InChI

InChI=1S/C13H9F3N2O4/c14-13(15,16)10-9(2-1-3-18-10)22-12(21)8-4-7(11(19)20)5-17-6-8/h1-3,5-6,17H,4H2,(H,19,20)/p-1