2-[4-(4-octylphenyl)phenyl]-4-propyl-pyrimidine

Systemtic Name: 2-[4-(4-octylphenyl)phenyl]-4-propyl-pyrimidine Openeye Name: 2-[4-(4-octylphenyl)phenyl]-4-propyl-pyrimidine CAS Name: 2-[4-(4-octylphenyl)phenyl]-4-propylpyrimidine IUPAC Name: 2-[4-(4-octylphenyl)phenyl]-4-propylpyrimidine Traditional Name: 2-[4-(4-octylphenyl)phenyl]-4-propyl-pyrimidine Formula: C27H34N2 MolecularWeight: 386.57226

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=CC=C(C=C1)C2=CC=C(C=C2)C3=NC=CC(=N3)CCC

Isomeric SMILES

CCCCCCCCC1=CC=C(C=C1)C2=CC=C(C=C2)C3=NC=CC(=N3)CCC

InChI

InChI=1S/C27H34N2/c1-3-5-6-7-8-9-11-22-12-14-23(15-13-22)24-16-18-25(19-17-24)27-28-21-20-26(29-27)10-4-2/h12-21H,3-11H2,1-2H3