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

Systemtic Name: 5-[4-(2-fluoranyloctoxy)phenyl]-2-(4-heptoxyphenyl)pyrimidine Openeye Name: 5-[4-(2-fluorooctoxy)phenyl]-2-(4-heptoxyphenyl)pyrimidine CAS Name: 5-[4-(2-fluorooctoxy)phenyl]-2-(4-heptoxyphenyl)pyrimidine IUPAC Name: 5-[4-(2-fluorooctoxy)phenyl]-2-(4-heptoxyphenyl)pyrimidine Traditional Name: 5-[4-(2-fluorooctoxy)phenyl]-2-(4-heptoxyphenyl)pyrimidine Formula: C31H41FN2O2 MolecularWeight: 492.667843

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC1=CC=C(C=C1)C2=NC=C(C=N2)C3=CC=C(C=C3)OCC(CCCCCC)F

Isomeric SMILES

CCCCCCCOC1=CC=C(C=C1)C2=NC=C(C=N2)C3=CC=C(C=C3)OCC(CCCCCC)F

InChI

InChI=1S/C31H41FN2O2/c1-3-5-7-9-11-21-35-29-19-15-26(16-20-29)31-33-22-27(23-34-31)25-13-17-30(18-14-25)36-24-28(32)12-10-8-6-4-2/h13-20,22-23,28H,3-12,21,24H2,1-2H3