4,4,4-tris(fluoranyl)-2-methylidene-3-(2-methyl-1,2,4-triazol-3-yl)-3-oxidanyl-butanenitrile

Systemtic Name: 4,4,4-tris(fluoranyl)-2-methylidene-3-(2-methyl-1,2,4-triazol-3-yl)-3-oxidanyl-butanenitrile Openeye Name: 4,4,4-trifluoro-3-hydroxy-2-methylene-3-(2-methyl-1,2,4-triazol-3-yl)butanenitrile CAS Name: 4,4,4-trifluoro-3-hydroxy-2-methylene-3-(2-methyl-1,2,4-triazol-3-yl)butanenitrile IUPAC Name: 4,4,4-trifluoro-3-hydroxy-2-methylidene-3-(2-methyl-1,2,4-triazol-3-yl)butanenitrile Traditional Name: 2-[2,2,2-trifluoro-1-hydroxy-1-(2-methyl-1,2,4-triazol-3-yl)ethyl]acrylonitrile Formula: C8H7F3N4O MolecularWeight: 232.16259

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NC=N1)C(C(=C)C#N)(C(F)(F)F)O

Isomeric SMILES

CN1C(=NC=N1)C(C(=C)C#N)(C(F)(F)F)O

InChI

InChI=1S/C8H7F3N4O/c1-5(3-12)7(16,8(9,10)11)6-13-4-14-15(6)2/h4,16H,1H2,2H3