diethyl 1-[4-methyl-6-(trifluoromethyl)pyrimidin-2-yl]-1,2,3-triazole-4,5-dicarboxylate

Systemtic Name: diethyl 1-[4-methyl-6-(trifluoromethyl)pyrimidin-2-yl]-1,2,3-triazole-4,5-dicarboxylate Openeye Name: diethyl 1-[4-methyl-6-(trifluoromethyl)pyrimidin-2-yl]triazole-4,5-dicarboxylate CAS Name: 1-[4-methyl-6-(trifluoromethyl)-2-pyrimidinyl]triazole-4,5-dicarboxylic acid diethyl ester IUPAC Name: diethyl 1-[4-methyl-6-(trifluoromethyl)pyrimidin-2-yl]triazole-4,5-dicarboxylate Traditional Name: 1-[4-methyl-6-(trifluoromethyl)pyrimidin-2-yl]triazole-4,5-dicarboxylic acid diethyl ester Formula: C14H14F3N5O4 MolecularWeight: 373.28727

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(N=N1)C2=NC(=CC(=N2)C(F)(F)F)C)C(=O)OCC

Isomeric SMILES

CCOC(=O)C1=C(N(N=N1)C2=NC(=CC(=N2)C(F)(F)F)C)C(=O)OCC

InChI

InChI=1S/C14H14F3N5O4/c1-4-25-11(23)9-10(12(24)26-5-2)22(21-20-9)13-18-7(3)6-8(19-13)14(15,16)17/h6H,4-5H2,1-3H3