2-[4-(3-fluoranyloctoxy)phenyl]-5-heptyl-pyrimidine

Systemtic Name: 2-[4-(3-fluoranyloctoxy)phenyl]-5-heptyl-pyrimidine Openeye Name: 2-[4-(3-fluorooctoxy)phenyl]-5-heptyl-pyrimidine CAS Name: 2-[4-(3-fluorooctoxy)phenyl]-5-heptylpyrimidine IUPAC Name: 2-[4-(3-fluorooctoxy)phenyl]-5-heptylpyrimidine Traditional Name: 2-[4-(3-fluorooctoxy)phenyl]-5-heptyl-pyrimidine Formula: C25H37FN2O MolecularWeight: 400.572483

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1=CN=C(N=C1)C2=CC=C(C=C2)OCCC(CCCCC)F

Isomeric SMILES

CCCCCCCC1=CN=C(N=C1)C2=CC=C(C=C2)OCCC(CCCCC)F

InChI

InChI=1S/C25H37FN2O/c1-3-5-7-8-10-11-21-19-27-25(28-20-21)22-13-15-24(16-14-22)29-18-17-23(26)12-9-6-4-2/h13-16,19-20,23H,3-12,17-18H2,1-2H3