2-(3-chlorophenyl)-2-(4,6-dimethoxypyrimidin-2-yl)ethanenitrile

Systemtic Name: 2-(3-chlorophenyl)-2-(4,6-dimethoxypyrimidin-2-yl)ethanenitrile Openeye Name: 2-(3-chlorophenyl)-2-(4,6-dimethoxypyrimidin-2-yl)acetonitrile CAS Name: 2-(3-chlorophenyl)-2-(4,6-dimethoxy-2-pyrimidinyl)acetonitrile IUPAC Name: 2-(3-chlorophenyl)-2-(4,6-dimethoxypyrimidin-2-yl)acetonitrile Traditional Name: 2-(3-chlorophenyl)-2-(4,6-dimethoxypyrimidin-2-yl)acetonitrile Formula: C14H12ClN3O2 MolecularWeight: 289.71698

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=NC(=N1)C(C#N)C2=CC(=CC=C2)Cl)OC

Isomeric SMILES

COC1=CC(=NC(=N1)C(C#N)C2=CC(=CC=C2)Cl)OC

InChI

InChI=1S/C14H12ClN3O2/c1-19-12-7-13(20-2)18-14(17-12)11(8-16)9-4-3-5-10(15)6-9/h3-7,11H,1-2H3