4-(5-butoxypyrimidin-2-yl)benzenecarbonitrile

Systemtic Name: 4-(5-butoxypyrimidin-2-yl)benzenecarbonitrile Openeye Name: 4-(5-butoxypyrimidin-2-yl)benzonitrile CAS Name: 4-(5-butoxy-2-pyrimidinyl)benzonitrile IUPAC Name: 4-(5-butoxypyrimidin-2-yl)benzonitrile Traditional Name: 4-(5-butoxypyrimidin-2-yl)benzonitrile Formula: C15H15N3O MolecularWeight: 253.2991

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CN=C(N=C1)C2=CC=C(C=C2)C#N

Isomeric SMILES

CCCCOC1=CN=C(N=C1)C2=CC=C(C=C2)C#N

InChI

InChI=1S/C15H15N3O/c1-2-3-8-19-14-10-17-15(18-11-14)13-6-4-12(9-16)5-7-13/h4-7,10-11H,2-3,8H2,1H3