(2S)-2-(tert-butylamino)-2-(3-methylphenyl)ethanenitrile

Systemtic Name: (2S)-2-(tert-butylamino)-2-(3-methylphenyl)ethanenitrile Openeye Name: (2S)-2-(tert-butylamino)-2-(m-tolyl)acetonitrile CAS Name: (2S)-2-(tert-butylamino)-2-(3-methylphenyl)acetonitrile IUPAC Name: (2S)-2-(tert-butylamino)-2-(3-methylphenyl)acetonitrile Traditional Name: (2S)-2-(tert-butylamino)-2-(m-tolyl)acetonitrile Formula: C13H18N2 MolecularWeight: 202.29542

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)C(C#N)NC(C)(C)C

Isomeric SMILES

CC1=CC(=CC=C1)[C@@H](C#N)NC(C)(C)C

InChI

InChI=1S/C13H18N2/c1-10-6-5-7-11(8-10)12(9-14)15-13(2,3)4/h5-8,12,15H,1-4H3/t12-/m1/s1