(2S)-2-(4-propoxyphenyl)-2-(pyridin-3-ylmethylamino)ethanenitrile

Systemtic Name: (2S)-2-(4-propoxyphenyl)-2-(pyridin-3-ylmethylamino)ethanenitrile Openeye Name: (2S)-2-(4-propoxyphenyl)-2-(3-pyridylmethylamino)acetonitrile CAS Name: (2S)-2-(4-propoxyphenyl)-2-(3-pyridinylmethylamino)acetonitrile IUPAC Name: (2S)-2-(4-propoxyphenyl)-2-(pyridin-3-ylmethylamino)acetonitrile Traditional Name: (2S)-2-(4-propoxyphenyl)-2-(3-pyridylmethylamino)acetonitrile Formula: C17H19N3O MolecularWeight: 281.35226

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)C(C#N)NCC2=CN=CC=C2

Isomeric SMILES

CCCOC1=CC=C(C=C1)[C@@H](C#N)NCC2=CN=CC=C2

InChI

InChI=1S/C17H19N3O/c1-2-10-21-16-7-5-15(6-8-16)17(11-18)20-13-14-4-3-9-19-12-14/h3-9,12,17,20H,2,10,13H2,1H3/t17-/m1/s1