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

Systemtic Name: 2-[4-[4-(2-fluoranyloctoxy)phenyl]phenyl]-5-heptyl-pyrimidine Openeye Name: 2-[4-[4-(2-fluorooctoxy)phenyl]phenyl]-5-heptyl-pyrimidine CAS Name: 2-[4-[4-(2-fluorooctoxy)phenyl]phenyl]-5-heptylpyrimidine IUPAC Name: 2-[4-[4-(2-fluorooctoxy)phenyl]phenyl]-5-heptylpyrimidine Traditional Name: 2-[4-[4-(2-fluorooctoxy)phenyl]phenyl]-5-heptyl-pyrimidine Formula: C31H41FN2O MolecularWeight: 476.668443

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1=CN=C(N=C1)C2=CC=C(C=C2)C3=CC=C(C=C3)OCC(CCCCCC)F

Isomeric SMILES

CCCCCCCC1=CN=C(N=C1)C2=CC=C(C=C2)C3=CC=C(C=C3)OCC(CCCCCC)F

InChI

InChI=1S/C31H41FN2O/c1-3-5-7-9-10-12-25-22-33-31(34-23-25)28-16-14-26(15-17-28)27-18-20-30(21-19-27)35-24-29(32)13-11-8-6-4-2/h14-23,29H,3-13,24H2,1-2H3