2-[4-[2,4-bis(fluoranyl)nonoxy]phenyl]-5-undecyl-pyrimidine

Systemtic Name: 2-[4-[2,4-bis(fluoranyl)nonoxy]phenyl]-5-undecyl-pyrimidine Openeye Name: 2-[4-(2,4-difluorononoxy)phenyl]-5-undecyl-pyrimidine CAS Name: 2-[4-(2,4-difluorononoxy)phenyl]-5-undecylpyrimidine IUPAC Name: 2-[4-(2,4-difluorononoxy)phenyl]-5-undecylpyrimidine Traditional Name: 2-[4-(2,4-difluorononoxy)phenyl]-5-undecyl-pyrimidine Formula: C30H46F2N2O MolecularWeight: 488.695846

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC1=CN=C(N=C1)C2=CC=C(C=C2)OCC(CC(CCCCC)F)F

Isomeric SMILES

CCCCCCCCCCCC1=CN=C(N=C1)C2=CC=C(C=C2)OCC(CC(CCCCC)F)F

InChI

InChI=1S/C30H46F2N2O/c1-3-5-7-8-9-10-11-12-14-15-25-22-33-30(34-23-25)26-17-19-29(20-18-26)35-24-28(32)21-27(31)16-13-6-4-2/h17-20,22-23,27-28H,3-16,21,24H2,1-2H3