(2S)-2-(4-oxidanylpiperidin-1-yl)-2-[2-(trifluoromethyl)phenyl]ethanenitrile

Systemtic Name: (2S)-2-(4-oxidanylpiperidin-1-yl)-2-[2-(trifluoromethyl)phenyl]ethanenitrile Openeye Name: (2S)-2-(4-hydroxy-1-piperidyl)-2-[2-(trifluoromethyl)phenyl]acetonitrile CAS Name: (2S)-2-(4-hydroxy-1-piperidinyl)-2-[2-(trifluoromethyl)phenyl]acetonitrile IUPAC Name: (2S)-2-(4-hydroxypiperidin-1-yl)-2-[2-(trifluoromethyl)phenyl]acetonitrile Traditional Name: (2S)-2-(4-hydroxypiperidino)-2-[2-(trifluoromethyl)phenyl]acetonitrile Formula: C14H15F3N2O MolecularWeight: 284.27691

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1O)C(C#N)C2=CC=CC=C2C(F)(F)F

Isomeric SMILES

C1CN(CCC1O)[C@H](C#N)C2=CC=CC=C2C(F)(F)F

InChI

InChI=1S/C14H15F3N2O/c15-14(16,17)12-4-2-1-3-11(12)13(9-18)19-7-5-10(20)6-8-19/h1-4,10,13,20H,5-8H2/t13-/m1/s1