2-[4-(9-fluoranylundecyl)phenyl]-5-octyl-pyrimidine

Systemtic Name: 2-[4-(9-fluoranylundecyl)phenyl]-5-octyl-pyrimidine Openeye Name: 2-[4-(9-fluoroundecyl)phenyl]-5-octyl-pyrimidine CAS Name: 2-[4-(9-fluoroundecyl)phenyl]-5-octylpyrimidine IUPAC Name: 2-[4-(9-fluoroundecyl)phenyl]-5-octylpyrimidine Traditional Name: 2-[4-(9-fluoroundecyl)phenyl]-5-octyl-pyrimidine Formula: C29H45FN2 MolecularWeight: 440.679403

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=CN=C(N=C1)C2=CC=C(C=C2)CCCCCCCCC(CC)F

Isomeric SMILES

CCCCCCCCC1=CN=C(N=C1)C2=CC=C(C=C2)CCCCCCCCC(CC)F

InChI

InChI=1S/C29H45FN2/c1-3-5-6-7-10-14-17-26-23-31-29(32-24-26)27-21-19-25(20-22-27)16-13-11-8-9-12-15-18-28(30)4-2/h19-24,28H,3-18H2,1-2H3