2-[3-(2-cyanopropan-2-yl)-5-(pyridin-3-ylmethyl)phenyl]-2-methyl-propanenitrile

Systemtic Name: 2-[3-(2-cyanopropan-2-yl)-5-(pyridin-3-ylmethyl)phenyl]-2-methyl-propanenitrile Openeye Name: 2-[3-(1-cyano-1-methyl-ethyl)-5-(3-pyridylmethyl)phenyl]-2-methyl-propanenitrile CAS Name: 2-[3-(2-cyanopropan-2-yl)-5-(3-pyridinylmethyl)phenyl]-2-methylpropanenitrile IUPAC Name: 2-[3-(2-cyanopropan-2-yl)-5-(pyridin-3-ylmethyl)phenyl]-2-methylpropanenitrile Traditional Name: 2-[3-(1-cyano-1-methyl-ethyl)-5-(3-pyridylmethyl)phenyl]-2-methyl-propionitrile Formula: C20H21N3 MolecularWeight: 303.40084

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C#N)C1=CC(=CC(=C1)CC2=CN=CC=C2)C(C)(C)C#N

Isomeric SMILES

CC(C)(C#N)C1=CC(=CC(=C1)CC2=CN=CC=C2)C(C)(C)C#N

InChI

InChI=1S/C20H21N3/c1-19(2,13-21)17-9-16(8-15-6-5-7-23-12-15)10-18(11-17)20(3,4)14-22/h5-7,9-12H,8H2,1-4H3