2-(4-propoxyphenyl)pyrimidine-5-carbonitrile

Systemtic Name: 2-(4-propoxyphenyl)pyrimidine-5-carbonitrile Openeye Name: 2-(4-propoxyphenyl)pyrimidine-5-carbonitrile CAS Name: 2-(4-propoxyphenyl)-5-pyrimidinecarbonitrile IUPAC Name: 2-(4-propoxyphenyl)pyrimidine-5-carbonitrile Traditional Name: 2-(4-propoxyphenyl)pyrimidine-5-carbonitrile Formula: C14H13N3O MolecularWeight: 239.27252

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)C2=NC=C(C=N2)C#N

Isomeric SMILES

CCCOC1=CC=C(C=C1)C2=NC=C(C=N2)C#N

InChI

InChI=1S/C14H13N3O/c1-2-7-18-13-5-3-12(4-6-13)14-16-9-11(8-15)10-17-14/h3-6,9-10H,2,7H2,1H3