(2S)-2-(tert-butylamino)-2-(4-propoxyphenyl)ethanenitrile

Systemtic Name: (2S)-2-(tert-butylamino)-2-(4-propoxyphenyl)ethanenitrile Openeye Name: (2S)-2-(tert-butylamino)-2-(4-propoxyphenyl)acetonitrile CAS Name: (2S)-2-(tert-butylamino)-2-(4-propoxyphenyl)acetonitrile IUPAC Name: (2S)-2-(tert-butylamino)-2-(4-propoxyphenyl)acetonitrile Traditional Name: (2S)-2-(tert-butylamino)-2-(4-propoxyphenyl)acetonitrile Formula: C15H22N2O MolecularWeight: 246.34798

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)C(C#N)NC(C)(C)C

Isomeric SMILES

CCCOC1=CC=C(C=C1)[C@@H](C#N)NC(C)(C)C

InChI

InChI=1S/C15H22N2O/c1-5-10-18-13-8-6-12(7-9-13)14(11-16)17-15(2,3)4/h6-9,14,17H,5,10H2,1-4H3/t14-/m1/s1