5-[4-(2-fluoranylpropoxy)phenyl]-2-(4-octylphenyl)pyrimidine

Systemtic Name: 5-[4-(2-fluoranylpropoxy)phenyl]-2-(4-octylphenyl)pyrimidine Openeye Name: 5-[4-(2-fluoropropoxy)phenyl]-2-(4-octylphenyl)pyrimidine CAS Name: 5-[4-(2-fluoropropoxy)phenyl]-2-(4-octylphenyl)pyrimidine IUPAC Name: 5-[4-(2-fluoropropoxy)phenyl]-2-(4-octylphenyl)pyrimidine Traditional Name: 5-[4-(2-fluoropropoxy)phenyl]-2-(4-octylphenyl)pyrimidine Formula: C27H33FN2O MolecularWeight: 420.562123

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=CC=C(C=C1)C2=NC=C(C=N2)C3=CC=C(C=C3)OCC(C)F

Isomeric SMILES

CCCCCCCCC1=CC=C(C=C1)C2=NC=C(C=N2)C3=CC=C(C=C3)OCC(C)F

InChI

InChI=1S/C27H33FN2O/c1-3-4-5-6-7-8-9-22-10-12-24(13-11-22)27-29-18-25(19-30-27)23-14-16-26(17-15-23)31-20-21(2)28/h10-19,21H,3-9,20H2,1-2H3