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

Systemtic Name: 1-[4-(furan-2-yl)-6-(trifluoromethyl)pyrimidin-2-yl]pyrazole-3-carboxylate Openeye Name: 1-[4-(2-furyl)-6-(trifluoromethyl)pyrimidin-2-yl]pyrazole-3-carboxylate CAS Name: 1-[4-(2-furanyl)-6-(trifluoromethyl)-2-pyrimidinyl]-3-pyrazolecarboxylate IUPAC Name: 1-[4-(furan-2-yl)-6-(trifluoromethyl)pyrimidin-2-yl]pyrazole-3-carboxylate Traditional Name: 1-[4-(2-furyl)-6-(trifluoromethyl)pyrimidin-2-yl]pyrazole-3-carboxylate Formula: C13H6F3N4O3- MolecularWeight: 323.20695

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Descriptors Computed from Structure

Canonical SMILES:

C1=COC(=C1)C2=CC(=NC(=N2)N3C=CC(=N3)C(=O)[O-])C(F)(F)F

Isomeric SMILES

C1=COC(=C1)C2=CC(=NC(=N2)N3C=CC(=N3)C(=O)[O-])C(F)(F)F

InChI

InChI=1S/C13H7F3N4O3/c14-13(15,16)10-6-8(9-2-1-5-23-9)17-12(18-10)20-4-3-7(19-20)11(21)22/h1-6H,(H,21,22)/p-1