2-[4-(2-fluoranyl-3-methyl-hexoxy)phenyl]-5-octyl-pyrimidine

Systemtic Name: 2-[4-(2-fluoranyl-3-methyl-hexoxy)phenyl]-5-octyl-pyrimidine Openeye Name: 2-[4-(2-fluoro-3-methyl-hexoxy)phenyl]-5-octyl-pyrimidine CAS Name: 2-[4-(2-fluoro-3-methylhexoxy)phenyl]-5-octylpyrimidine IUPAC Name: 2-[4-(2-fluoro-3-methylhexoxy)phenyl]-5-octylpyrimidine Traditional Name: 2-[4-(2-fluoro-3-methyl-hexoxy)phenyl]-5-octyl-pyrimidine Formula: C25H37FN2O MolecularWeight: 400.572483

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H37FN2O/c1-4-6-7-8-9-10-12-21-17-27-25(28-18-21)22-13-15-23(16-14-22)29-19-24(26)20(3)11-5-2/h13-18,20,24H,4-12,19H2,1-3H3