methyl 2-[4-ethoxycarbonyl-5-(trifluoromethyl)pyrazol-1-yl]-4-(trifluoromethyl)pyrimidine-5-carboxylate

Systemtic Name: methyl 2-[4-ethoxycarbonyl-5-(trifluoromethyl)pyrazol-1-yl]-4-(trifluoromethyl)pyrimidine-5-carboxylate Openeye Name: methyl 2-[4-ethoxycarbonyl-5-(trifluoromethyl)pyrazol-1-yl]-4-(trifluoromethyl)pyrimidine-5-carboxylate CAS Name: 2-[4-ethoxycarbonyl-5-(trifluoromethyl)-1-pyrazolyl]-4-(trifluoromethyl)-5-pyrimidinecarboxylic acid methyl ester IUPAC Name: methyl 2-[4-ethoxycarbonyl-5-(trifluoromethyl)pyrazol-1-yl]-4-(trifluoromethyl)pyrimidine-5-carboxylate Traditional Name: 2-[4-carbethoxy-5-(trifluoromethyl)pyrazol-1-yl]-4-(trifluoromethyl)pyrimidine-5-carboxylic acid methyl ester Formula: C14H10F6N4O4 MolecularWeight: 412.244019

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(N=C1)C2=NC=C(C(=N2)C(F)(F)F)C(=O)OC)C(F)(F)F

Isomeric SMILES

CCOC(=O)C1=C(N(N=C1)C2=NC=C(C(=N2)C(F)(F)F)C(=O)OC)C(F)(F)F

InChI

InChI=1S/C14H10F6N4O4/c1-3-28-11(26)7-5-22-24(9(7)14(18,19)20)12-21-4-6(10(25)27-2)8(23-12)13(15,16)17/h4-5H,3H2,1-2H3