(2S)-2-(4-propan-2-yloxyphenyl)-2-(pyridin-4-ylmethylamino)ethanenitrile

Systemtic Name: (2S)-2-(4-propan-2-yloxyphenyl)-2-(pyridin-4-ylmethylamino)ethanenitrile Openeye Name: (2S)-2-(4-isopropoxyphenyl)-2-(4-pyridylmethylamino)acetonitrile CAS Name: (2S)-2-(4-propan-2-yloxyphenyl)-2-(pyridin-4-ylmethylamino)acetonitrile IUPAC Name: (2S)-2-(4-propan-2-yloxyphenyl)-2-(pyridin-4-ylmethylamino)acetonitrile Traditional Name: (2S)-2-(4-isopropoxyphenyl)-2-(4-pyridylmethylamino)acetonitrile Formula: C17H19N3O MolecularWeight: 281.35226

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC=C(C=C1)C(C#N)NCC2=CC=NC=C2

Isomeric SMILES

CC(C)OC1=CC=C(C=C1)[C@@H](C#N)NCC2=CC=NC=C2

InChI

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