5-decyl-2-[4-(2-fluoranyl-3-methyl-heptoxy)phenyl]pyrimidine

Systemtic Name: 5-decyl-2-[4-(2-fluoranyl-3-methyl-heptoxy)phenyl]pyrimidine Openeye Name: 5-decyl-2-[4-(2-fluoro-3-methyl-heptoxy)phenyl]pyrimidine CAS Name: 5-decyl-2-[4-(2-fluoro-3-methylheptoxy)phenyl]pyrimidine IUPAC Name: 5-decyl-2-[4-(2-fluoro-3-methylheptoxy)phenyl]pyrimidine Traditional Name: 5-decyl-2-[4-(2-fluoro-3-methyl-heptoxy)phenyl]pyrimidine Formula: C28H43FN2O MolecularWeight: 442.652223

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCC1=CN=C(N=C1)C2=CC=C(C=C2)OCC(C(C)CCCC)F

Isomeric SMILES

CCCCCCCCCCC1=CN=C(N=C1)C2=CC=C(C=C2)OCC(C(C)CCCC)F

InChI

InChI=1S/C28H43FN2O/c1-4-6-8-9-10-11-12-13-15-24-20-30-28(31-21-24)25-16-18-26(19-17-25)32-22-27(29)23(3)14-7-5-2/h16-21,23,27H,4-15,22H2,1-3H3