2-(4-dodecylphenyl)-5-[4-(2-fluoranyl-4-methyl-pentoxy)phenyl]pyrimidine

Systemtic Name: 2-(4-dodecylphenyl)-5-[4-(2-fluoranyl-4-methyl-pentoxy)phenyl]pyrimidine Openeye Name: 2-(4-dodecylphenyl)-5-[4-(2-fluoro-4-methyl-pentoxy)phenyl]pyrimidine CAS Name: 2-(4-dodecylphenyl)-5-[4-(2-fluoro-4-methylpentoxy)phenyl]pyrimidine IUPAC Name: 2-(4-dodecylphenyl)-5-[4-(2-fluoro-4-methylpentoxy)phenyl]pyrimidine Traditional Name: 5-[4-(2-fluoro-4-methyl-pentoxy)phenyl]-2-(4-laurylphenyl)pyrimidine Formula: C34H47FN2O MolecularWeight: 518.748183

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC1=CC=C(C=C1)C2=NC=C(C=N2)C3=CC=C(C=C3)OCC(CC(C)C)F

Isomeric SMILES

CCCCCCCCCCCCC1=CC=C(C=C1)C2=NC=C(C=N2)C3=CC=C(C=C3)OCC(CC(C)C)F

InChI

InChI=1S/C34H47FN2O/c1-4-5-6-7-8-9-10-11-12-13-14-28-15-17-30(18-16-28)34-36-24-31(25-37-34)29-19-21-33(22-20-29)38-26-32(35)23-27(2)3/h15-22,24-25,27,32H,4-14,23,26H2,1-3H3