methyl 1-[4-(furan-2-yl)-6-(trifluoromethyl)pyrimidin-2-yl]-4-nitro-pyrazole-3-carboxylate

Systemtic Name: methyl 1-[4-(furan-2-yl)-6-(trifluoromethyl)pyrimidin-2-yl]-4-nitro-pyrazole-3-carboxylate Openeye Name: methyl 1-[4-(2-furyl)-6-(trifluoromethyl)pyrimidin-2-yl]-4-nitro-pyrazole-3-carboxylate CAS Name: 1-[4-(2-furanyl)-6-(trifluoromethyl)-2-pyrimidinyl]-4-nitro-3-pyrazolecarboxylic acid methyl ester IUPAC Name: methyl 1-[4-(furan-2-yl)-6-(trifluoromethyl)pyrimidin-2-yl]-4-nitropyrazole-3-carboxylate Traditional Name: 1-[4-(2-furyl)-6-(trifluoromethyl)pyrimidin-2-yl]-4-nitro-pyrazole-3-carboxylic acid methyl ester Formula: C14H8F3N5O5 MolecularWeight: 383.23903

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=NN(C=C1[N+](=O)[O-])C2=NC(=CC(=N2)C(F)(F)F)C3=CC=CO3

Isomeric SMILES

COC(=O)C1=NN(C=C1[N+](=O)[O-])C2=NC(=CC(=N2)C(F)(F)F)C3=CC=CO3

InChI

InChI=1S/C14H8F3N5O5/c1-26-12(23)11-8(22(24)25)6-21(20-11)13-18-7(9-3-2-4-27-9)5-10(19-13)14(15,16)17/h2-6H,1H3