5-dodecyl-2-[4-(3-fluoranylundecoxy)phenyl]pyrimidine

Systemtic Name: 5-dodecyl-2-[4-(3-fluoranylundecoxy)phenyl]pyrimidine Openeye Name: 5-dodecyl-2-[4-(3-fluoroundecoxy)phenyl]pyrimidine CAS Name: 5-dodecyl-2-[4-(3-fluoroundecoxy)phenyl]pyrimidine IUPAC Name: 5-dodecyl-2-[4-(3-fluoroundecoxy)phenyl]pyrimidine Traditional Name: 2-[4-(3-fluoroundecoxy)phenyl]-5-lauryl-pyrimidine Formula: C33H53FN2O MolecularWeight: 512.785123

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC1=CN=C(N=C1)C2=CC=C(C=C2)OCCC(CCCCCCCC)F

Isomeric SMILES

CCCCCCCCCCCCC1=CN=C(N=C1)C2=CC=C(C=C2)OCCC(CCCCCCCC)F

InChI

InChI=1S/C33H53FN2O/c1-3-5-7-9-11-12-13-14-15-17-19-29-27-35-33(36-28-29)30-21-23-32(24-22-30)37-26-25-31(34)20-18-16-10-8-6-4-2/h21-24,27-28,31H,3-20,25-26H2,1-2H3