2-[(6-chloranylpyridin-3-yl)methyl]-2-[3,3,3-tris(fluoranyl)propyl]propanedinitrile

Systemtic Name: 2-[(6-chloranylpyridin-3-yl)methyl]-2-[3,3,3-tris(fluoranyl)propyl]propanedinitrile Openeye Name: 2-[(6-chloro-3-pyridyl)methyl]-2-(3,3,3-trifluoropropyl)propanedinitrile CAS Name: 2-[(6-chloro-3-pyridinyl)methyl]-2-(3,3,3-trifluoropropyl)propanedinitrile IUPAC Name: 2-[(6-chloropyridin-3-yl)methyl]-2-(3,3,3-trifluoropropyl)propanedinitrile Traditional Name: 2-[(6-chloro-3-pyridyl)methyl]-2-(3,3,3-trifluoropropyl)malononitrile Formula: C12H9ClF3N3 MolecularWeight: 287.66817

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=NC=C1CC(CCC(F)(F)F)(C#N)C#N)Cl

Isomeric SMILES

C1=CC(=NC=C1CC(CCC(F)(F)F)(C#N)C#N)Cl

InChI

InChI=1S/C12H9ClF3N3/c13-10-2-1-9(6-19-10)5-11(7-17,8-18)3-4-12(14,15)16/h1-2,6H,3-5H2