2-[6-[4-(trifluoromethyl)phenyl]hex-5-ynyl]propanedinitrile

Systemtic Name: 2-[6-[4-(trifluoromethyl)phenyl]hex-5-ynyl]propanedinitrile Openeye Name: 2-[6-[4-(trifluoromethyl)phenyl]hex-5-ynyl]propanedinitrile CAS Name: 2-[6-[4-(trifluoromethyl)phenyl]hex-5-ynyl]propanedinitrile IUPAC Name: 2-[6-[4-(trifluoromethyl)phenyl]hex-5-ynyl]propanedinitrile Traditional Name: 2-[6-[4-(trifluoromethyl)phenyl]hex-5-ynyl]malononitrile Formula: C16H13F3N2 MolecularWeight: 290.28303

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C#CCCCCC(C#N)C#N)C(F)(F)F

Isomeric SMILES

C1=CC(=CC=C1C#CCCCCC(C#N)C#N)C(F)(F)F

InChI

InChI=1S/C16H13F3N2/c17-16(18,19)15-9-7-13(8-10-15)5-3-1-2-4-6-14(11-20)12-21/h7-10,14H,1-2,4,6H2