5-hexyl-2-[2-(4-pentoxyphenyl)ethynyl]pyrimidine

Systemtic Name: 5-hexyl-2-[2-(4-pentoxyphenyl)ethynyl]pyrimidine Openeye Name: 5-hexyl-2-[2-(4-pentoxyphenyl)ethynyl]pyrimidine CAS Name: 5-hexyl-2-[2-(4-pentoxyphenyl)ethynyl]pyrimidine IUPAC Name: 5-hexyl-2-[2-(4-pentoxyphenyl)ethynyl]pyrimidine Traditional Name: 2-[2-(4-amoxyphenyl)ethynyl]-5-hexyl-pyrimidine Formula: C23H30N2O MolecularWeight: 350.4971

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=CN=C(N=C1)C#CC2=CC=C(C=C2)OCCCCC

Isomeric SMILES

CCCCCCC1=CN=C(N=C1)C#CC2=CC=C(C=C2)OCCCCC

InChI

InChI=1S/C23H30N2O/c1-3-5-7-8-10-21-18-24-23(25-19-21)16-13-20-11-14-22(15-12-20)26-17-9-6-4-2/h11-12,14-15,18-19H,3-10,17H2,1-2H3