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

Systemtic Name: 2-[4-(3-fluoranyl-4-methyl-heptoxy)phenyl]-5-undecyl-pyrimidine Openeye Name: 2-[4-(3-fluoro-4-methyl-heptoxy)phenyl]-5-undecyl-pyrimidine CAS Name: 2-[4-(3-fluoro-4-methylheptoxy)phenyl]-5-undecylpyrimidine IUPAC Name: 2-[4-(3-fluoro-4-methylheptoxy)phenyl]-5-undecylpyrimidine Traditional Name: 2-[4-(3-fluoro-4-methyl-heptoxy)phenyl]-5-undecyl-pyrimidine Formula: C29H45FN2O MolecularWeight: 456.678803

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC1=CN=C(N=C1)C2=CC=C(C=C2)OCCC(C(C)CCC)F

Isomeric SMILES

CCCCCCCCCCCC1=CN=C(N=C1)C2=CC=C(C=C2)OCCC(C(C)CCC)F

InChI

InChI=1S/C29H45FN2O/c1-4-6-7-8-9-10-11-12-13-15-25-22-31-29(32-23-25)26-16-18-27(19-17-26)33-21-20-28(30)24(3)14-5-2/h16-19,22-24,28H,4-15,20-21H2,1-3H3