5-[4-(2-fluoranylbutoxy)phenyl]-2-(4-heptylphenyl)pyrimidine

Systemtic Name: 5-[4-(2-fluoranylbutoxy)phenyl]-2-(4-heptylphenyl)pyrimidine Openeye Name: 5-[4-(2-fluorobutoxy)phenyl]-2-(4-heptylphenyl)pyrimidine CAS Name: 5-[4-(2-fluorobutoxy)phenyl]-2-(4-heptylphenyl)pyrimidine IUPAC Name: 5-[4-(2-fluorobutoxy)phenyl]-2-(4-heptylphenyl)pyrimidine Traditional Name: 5-[4-(2-fluorobutoxy)phenyl]-2-(4-heptylphenyl)pyrimidine Formula: C27H33FN2O MolecularWeight: 420.562123

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1=CC=C(C=C1)C2=NC=C(C=N2)C3=CC=C(C=C3)OCC(CC)F

Isomeric SMILES

CCCCCCCC1=CC=C(C=C1)C2=NC=C(C=N2)C3=CC=C(C=C3)OCC(CC)F

InChI

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