2-[4-[[(2S)-4-methyl-1-oxidanyl-pentan-2-yl]amino]-2-(trifluoromethyl)phenyl]ethanenitrile

Systemtic Name: 2-[4-[[(2S)-4-methyl-1-oxidanyl-pentan-2-yl]amino]-2-(trifluoromethyl)phenyl]ethanenitrile Openeye Name: 2-[4-[[(1S)-1-(hydroxymethyl)-3-methyl-butyl]amino]-2-(trifluoromethyl)phenyl]acetonitrile CAS Name: 2-[4-[[(2S)-1-hydroxy-4-methylpentan-2-yl]amino]-2-(trifluoromethyl)phenyl]acetonitrile IUPAC Name: 2-[4-[[(2S)-1-hydroxy-4-methylpentan-2-yl]amino]-2-(trifluoromethyl)phenyl]acetonitrile Traditional Name: 2-[4-[[(1S)-3-methyl-1-methylol-butyl]amino]-2-(trifluoromethyl)phenyl]acetonitrile Formula: C15H19F3N2O MolecularWeight: 300.31937

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(CO)NC1=CC(=C(C=C1)CC#N)C(F)(F)F

Isomeric SMILES

CC(C)C[C@@H](CO)NC1=CC(=C(C=C1)CC#N)C(F)(F)F

InChI

InChI=1S/C15H19F3N2O/c1-10(2)7-13(9-21)20-12-4-3-11(5-6-19)14(8-12)15(16,17)18/h3-4,8,10,13,20-21H,5,7,9H2,1-2H3/t13-/m0/s1