4-[4-(2-methoxypyrimidin-5-yl)phenyl]benzenecarbonitrile

Systemtic Name: 4-[4-(2-methoxypyrimidin-5-yl)phenyl]benzenecarbonitrile Openeye Name: 4-[4-(2-methoxypyrimidin-5-yl)phenyl]benzonitrile CAS Name: 4-[4-(2-methoxy-5-pyrimidinyl)phenyl]benzonitrile IUPAC Name: 4-[4-(2-methoxypyrimidin-5-yl)phenyl]benzonitrile Traditional Name: 4-[4-(2-methoxypyrimidin-5-yl)phenyl]benzonitrile Formula: C18H13N3O MolecularWeight: 287.31532

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Descriptors Computed from Structure

Canonical SMILES:

COC1=NC=C(C=N1)C2=CC=C(C=C2)C3=CC=C(C=C3)C#N

Isomeric SMILES

COC1=NC=C(C=N1)C2=CC=C(C=C2)C3=CC=C(C=C3)C#N

InChI

InChI=1S/C18H13N3O/c1-22-18-20-11-17(12-21-18)16-8-6-15(7-9-16)14-4-2-13(10-19)3-5-14/h2-9,11-12H,1H3