2-[3,5-bis(4-fluorophenyl)-1,2,4-triazol-1-yl]-2-oxidanyl-ethanenitrile

Systemtic Name: 2-[3,5-bis(4-fluorophenyl)-1,2,4-triazol-1-yl]-2-oxidanyl-ethanenitrile Openeye Name: 2-[3,5-bis(4-fluorophenyl)-1,2,4-triazol-1-yl]-2-hydroxy-acetonitrile CAS Name: 2-[3,5-bis(4-fluorophenyl)-1,2,4-triazol-1-yl]-2-hydroxyacetonitrile IUPAC Name: 2-[3,5-bis(4-fluorophenyl)-1,2,4-triazol-1-yl]-2-hydroxyacetonitrile Traditional Name: 2-[3,5-bis(4-fluorophenyl)-1,2,4-triazol-1-yl]-2-hydroxy-acetonitrile Formula: C16H10F2N4O MolecularWeight: 312.273606

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=NN(C(=N2)C3=CC=C(C=C3)F)C(C#N)O)F

Isomeric SMILES

C1=CC(=CC=C1C2=NN(C(=N2)C3=CC=C(C=C3)F)C(C#N)O)F

InChI

InChI=1S/C16H10F2N4O/c17-12-5-1-10(2-6-12)15-20-16(22(21-15)14(23)9-19)11-3-7-13(18)8-4-11/h1-8,14,23H