2-[4-(9-fluoranylundecyl)phenyl]-5-methyl-pyrimidine

Systemtic Name: 2-[4-(9-fluoranylundecyl)phenyl]-5-methyl-pyrimidine Openeye Name: 2-[4-(9-fluoroundecyl)phenyl]-5-methyl-pyrimidine CAS Name: 2-[4-(9-fluoroundecyl)phenyl]-5-methylpyrimidine IUPAC Name: 2-[4-(9-fluoroundecyl)phenyl]-5-methylpyrimidine Traditional Name: 2-[4-(9-fluoroundecyl)phenyl]-5-methyl-pyrimidine Formula: C22H31FN2 MolecularWeight: 342.493343

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CCCCCCCCC1=CC=C(C=C1)C2=NC=C(C=N2)C)F

Isomeric SMILES

CCC(CCCCCCCCC1=CC=C(C=C1)C2=NC=C(C=N2)C)F

InChI

InChI=1S/C22H31FN2/c1-3-21(23)11-9-7-5-4-6-8-10-19-12-14-20(15-13-19)22-24-16-18(2)17-25-22/h12-17,21H,3-11H2,1-2H3