4-[[(2S)-butan-2-yl]-ethyl-amino]-2-(trifluoromethyl)benzenecarbonitrile

Systemtic Name: 4-[[(2S)-butan-2-yl]-ethyl-amino]-2-(trifluoromethyl)benzenecarbonitrile Openeye Name: 4-[ethyl-[(1S)-1-methylpropyl]amino]-2-(trifluoromethyl)benzonitrile CAS Name: 4-[[(2S)-butan-2-yl]-ethylamino]-2-(trifluoromethyl)benzonitrile IUPAC Name: 4-[[(2S)-butan-2-yl]-ethylamino]-2-(trifluoromethyl)benzonitrile Traditional Name: 4-[ethyl-[(1S)-1-methylpropyl]amino]-2-(trifluoromethyl)benzonitrile Formula: C14H17F3N2 MolecularWeight: 270.29339

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)N(CC)C1=CC(=C(C=C1)C#N)C(F)(F)F

Isomeric SMILES

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

InChI

InChI=1S/C14H17F3N2/c1-4-10(3)19(5-2)12-7-6-11(9-18)13(8-12)14(15,16)17/h6-8,10H,4-5H2,1-3H3/t10-/m0/s1