5-fluoranyl-2-methoxy-4-[4-methyl-5-oxidanylidene-3-(trifluoromethyl)-1,2,4-triazol-1-yl]benzenecarbonitrile

Systemtic Name: 5-fluoranyl-2-methoxy-4-[4-methyl-5-oxidanylidene-3-(trifluoromethyl)-1,2,4-triazol-1-yl]benzenecarbonitrile Openeye Name: 5-fluoro-2-methoxy-4-[4-methyl-5-oxo-3-(trifluoromethyl)-1,2,4-triazol-1-yl]benzonitrile CAS Name: 5-fluoro-2-methoxy-4-[4-methyl-5-oxo-3-(trifluoromethyl)-1,2,4-triazol-1-yl]benzonitrile IUPAC Name: 5-fluoro-2-methoxy-4-[4-methyl-5-oxo-3-(trifluoromethyl)-1,2,4-triazol-1-yl]benzonitrile Traditional Name: 5-fluoro-4-[5-keto-4-methyl-3-(trifluoromethyl)-1,2,4-triazol-1-yl]-2-methoxy-benzonitrile Formula: C12H8F4N4O2 MolecularWeight: 316.211133

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN(C1=O)C2=C(C=C(C(=C2)OC)C#N)F)C(F)(F)F

Isomeric SMILES

CN1C(=NN(C1=O)C2=C(C=C(C(=C2)OC)C#N)F)C(F)(F)F

InChI

InChI=1S/C12H8F4N4O2/c1-19-10(12(14,15)16)18-20(11(19)21)8-4-9(22-2)6(5-17)3-7(8)13/h3-4H,1-2H3