2-[4-(3-fluoranyl-5-methyl-octoxy)phenyl]-5-undecyl-pyrimidine

Systemtic Name: 2-[4-(3-fluoranyl-5-methyl-octoxy)phenyl]-5-undecyl-pyrimidine Openeye Name: 2-[4-(3-fluoro-5-methyl-octoxy)phenyl]-5-undecyl-pyrimidine CAS Name: 2-[4-(3-fluoro-5-methyloctoxy)phenyl]-5-undecylpyrimidine IUPAC Name: 2-[4-(3-fluoro-5-methyloctoxy)phenyl]-5-undecylpyrimidine Traditional Name: 2-[4-(3-fluoro-5-methyl-octoxy)phenyl]-5-undecyl-pyrimidine Formula: C30H47FN2O MolecularWeight: 470.705383

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC1=CN=C(N=C1)C2=CC=C(C=C2)OCCC(CC(C)CCC)F

Isomeric SMILES

CCCCCCCCCCCC1=CN=C(N=C1)C2=CC=C(C=C2)OCCC(CC(C)CCC)F

InChI

InChI=1S/C30H47FN2O/c1-4-6-7-8-9-10-11-12-13-15-26-23-32-30(33-24-26)27-16-18-29(19-17-27)34-21-20-28(31)22-25(3)14-5-2/h16-19,23-25,28H,4-15,20-22H2,1-3H3