(2S)-2-(3-methoxypropylamino)-2-[2-(trifluoromethyl)phenyl]ethanenitrile

Systemtic Name: (2S)-2-(3-methoxypropylamino)-2-[2-(trifluoromethyl)phenyl]ethanenitrile Openeye Name: (2S)-2-(3-methoxypropylamino)-2-[2-(trifluoromethyl)phenyl]acetonitrile CAS Name: (2S)-2-(3-methoxypropylamino)-2-[2-(trifluoromethyl)phenyl]acetonitrile IUPAC Name: (2S)-2-(3-methoxypropylamino)-2-[2-(trifluoromethyl)phenyl]acetonitrile Traditional Name: (2S)-2-(3-methoxypropylamino)-2-[2-(trifluoromethyl)phenyl]acetonitrile Formula: C13H15F3N2O MolecularWeight: 272.26621

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

COCCCN[C@H](C#N)C1=CC=CC=C1C(F)(F)F

InChI

InChI=1S/C13H15F3N2O/c1-19-8-4-7-18-12(9-17)10-5-2-3-6-11(10)13(14,15)16/h2-3,5-6,12,18H,4,7-8H2,1H3/t12-/m1/s1