2-[4-[2,3-bis(fluoranyl)heptoxy]phenyl]-5-dodecyl-pyrimidine

Systemtic Name: 2-[4-[2,3-bis(fluoranyl)heptoxy]phenyl]-5-dodecyl-pyrimidine Openeye Name: 2-[4-(2,3-difluoroheptoxy)phenyl]-5-dodecyl-pyrimidine CAS Name: 2-[4-(2,3-difluoroheptoxy)phenyl]-5-dodecylpyrimidine IUPAC Name: 2-[4-(2,3-difluoroheptoxy)phenyl]-5-dodecylpyrimidine Traditional Name: 2-[4-(2,3-difluoroheptoxy)phenyl]-5-lauryl-pyrimidine Formula: C29H44F2N2O MolecularWeight: 474.669266

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC1=CN=C(N=C1)C2=CC=C(C=C2)OCC(C(CCCC)F)F

Isomeric SMILES

CCCCCCCCCCCCC1=CN=C(N=C1)C2=CC=C(C=C2)OCC(C(CCCC)F)F

InChI

InChI=1S/C29H44F2N2O/c1-3-5-7-8-9-10-11-12-13-14-15-24-21-32-29(33-22-24)25-17-19-26(20-18-25)34-23-28(31)27(30)16-6-4-2/h17-22,27-28H,3-16,23H2,1-2H3