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

Systemtic Name: 5-(2-fluoranyloctoxy)-2-[4-(4-pentylphenyl)phenyl]pyrimidine Openeye Name: 5-(2-fluorooctoxy)-2-[4-(4-pentylphenyl)phenyl]pyrimidine CAS Name: 5-(2-fluorooctoxy)-2-[4-(4-pentylphenyl)phenyl]pyrimidine IUPAC Name: 5-(2-fluorooctoxy)-2-[4-(4-pentylphenyl)phenyl]pyrimidine Traditional Name: 2-[4-(4-amylphenyl)phenyl]-5-(2-fluorooctoxy)pyrimidine Formula: C29H37FN2O MolecularWeight: 448.615283

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(COC1=CN=C(N=C1)C2=CC=C(C=C2)C3=CC=C(C=C3)CCCCC)F

Isomeric SMILES

CCCCCCC(COC1=CN=C(N=C1)C2=CC=C(C=C2)C3=CC=C(C=C3)CCCCC)F

InChI

InChI=1S/C29H37FN2O/c1-3-5-7-9-11-27(30)22-33-28-20-31-29(32-21-28)26-18-16-25(17-19-26)24-14-12-23(13-15-24)10-8-6-4-2/h12-21,27H,3-11,22H2,1-2H3