2-(4-pentylphenyl)-5-[4-(4-propoxybutoxy)phenyl]pyrimidine

Systemtic Name: 2-(4-pentylphenyl)-5-[4-(4-propoxybutoxy)phenyl]pyrimidine Openeye Name: 2-(4-pentylphenyl)-5-[4-(4-propoxybutoxy)phenyl]pyrimidine CAS Name: 2-(4-pentylphenyl)-5-[4-(4-propoxybutoxy)phenyl]pyrimidine IUPAC Name: 2-(4-pentylphenyl)-5-[4-(4-propoxybutoxy)phenyl]pyrimidine Traditional Name: 2-(4-amylphenyl)-5-[4-(4-propoxybutoxy)phenyl]pyrimidine Formula: C28H36N2O2 MolecularWeight: 432.59764

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC=C(C=C1)C2=NC=C(C=N2)C3=CC=C(C=C3)OCCCCOCCC

Isomeric SMILES

CCCCCC1=CC=C(C=C1)C2=NC=C(C=N2)C3=CC=C(C=C3)OCCCCOCCC

InChI

InChI=1S/C28H36N2O2/c1-3-5-6-9-23-10-12-25(13-11-23)28-29-21-26(22-30-28)24-14-16-27(17-15-24)32-20-8-7-19-31-18-4-2/h10-17,21-22H,3-9,18-20H2,1-2H3