2-(3-oxidanylpropyl)-2-[[4-(trifluoromethyl)phenyl]methyl]propanedinitrile

Systemtic Name: 2-(3-oxidanylpropyl)-2-[[4-(trifluoromethyl)phenyl]methyl]propanedinitrile Openeye Name: 2-(3-hydroxypropyl)-2-[[4-(trifluoromethyl)phenyl]methyl]propanedinitrile CAS Name: 2-(3-hydroxypropyl)-2-[[4-(trifluoromethyl)phenyl]methyl]propanedinitrile IUPAC Name: 2-(3-hydroxypropyl)-2-[[4-(trifluoromethyl)phenyl]methyl]propanedinitrile Traditional Name: 2-(3-hydroxypropyl)-2-[4-(trifluoromethyl)benzyl]malononitrile Formula: C14H13F3N2O MolecularWeight: 282.26103

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CC(CCCO)(C#N)C#N)C(F)(F)F

Isomeric SMILES

C1=CC(=CC=C1CC(CCCO)(C#N)C#N)C(F)(F)F

InChI

InChI=1S/C14H13F3N2O/c15-14(16,17)12-4-2-11(3-5-12)8-13(9-18,10-19)6-1-7-20/h2-5,20H,1,6-8H2