(2S)-2-(pentylamino)-2-pyridin-2-yl-ethanenitrile

Systemtic Name: (2S)-2-(pentylamino)-2-pyridin-2-yl-ethanenitrile Openeye Name: (2S)-2-(pentylamino)-2-(2-pyridyl)acetonitrile CAS Name: (2S)-2-(pentylamino)-2-(2-pyridinyl)acetonitrile IUPAC Name: (2S)-2-(pentylamino)-2-pyridin-2-ylacetonitrile Traditional Name: (2S)-2-(amylamino)-2-(2-pyridyl)acetonitrile Formula: C12H17N3 MolecularWeight: 203.28348

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCNC(C#N)C1=CC=CC=N1

Isomeric SMILES

CCCCCN[C@H](C#N)C1=CC=CC=N1

InChI

InChI=1S/C12H17N3/c1-2-3-5-8-15-12(10-13)11-7-4-6-9-14-11/h4,6-7,9,12,15H,2-3,5,8H2,1H3/t12-/m1/s1