(2S)-2-[2-(2,5-dimethoxyphenyl)ethylamino]-2-pyridin-3-yl-ethanenitrile

Systemtic Name: (2S)-2-[2-(2,5-dimethoxyphenyl)ethylamino]-2-pyridin-3-yl-ethanenitrile Openeye Name: (2S)-2-[2-(2,5-dimethoxyphenyl)ethylamino]-2-(3-pyridyl)acetonitrile CAS Name: (2S)-2-[2-(2,5-dimethoxyphenyl)ethylamino]-2-(3-pyridinyl)acetonitrile IUPAC Name: (2S)-2-[2-(2,5-dimethoxyphenyl)ethylamino]-2-pyridin-3-ylacetonitrile Traditional Name: (2S)-2-[2-(2,5-dimethoxyphenyl)ethylamino]-2-(3-pyridyl)acetonitrile Formula: C17H19N3O2 MolecularWeight: 297.35166

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)CCNC(C#N)C2=CN=CC=C2

Isomeric SMILES

COC1=CC(=C(C=C1)OC)CCN[C@H](C#N)C2=CN=CC=C2

InChI

InChI=1S/C17H19N3O2/c1-21-15-5-6-17(22-2)13(10-15)7-9-20-16(11-18)14-4-3-8-19-12-14/h3-6,8,10,12,16,20H,7,9H2,1-2H3/t16-/m1/s1