2-[4-(2-fluoranyl-4-methyl-octoxy)phenyl]-5-octyl-pyrimidine

Systemtic Name: 2-[4-(2-fluoranyl-4-methyl-octoxy)phenyl]-5-octyl-pyrimidine Openeye Name: 2-[4-(2-fluoro-4-methyl-octoxy)phenyl]-5-octyl-pyrimidine CAS Name: 2-[4-(2-fluoro-4-methyloctoxy)phenyl]-5-octylpyrimidine IUPAC Name: 2-[4-(2-fluoro-4-methyloctoxy)phenyl]-5-octylpyrimidine Traditional Name: 2-[4-(2-fluoro-4-methyl-octoxy)phenyl]-5-octyl-pyrimidine Formula: C27H41FN2O MolecularWeight: 428.625643

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=CN=C(N=C1)C2=CC=C(C=C2)OCC(CC(C)CCCC)F

Isomeric SMILES

CCCCCCCCC1=CN=C(N=C1)C2=CC=C(C=C2)OCC(CC(C)CCCC)F

InChI

InChI=1S/C27H41FN2O/c1-4-6-8-9-10-11-13-23-19-29-27(30-20-23)24-14-16-26(17-15-24)31-21-25(28)18-22(3)12-7-5-2/h14-17,19-20,22,25H,4-13,18,21H2,1-3H3