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

Systemtic Name: 2-[4-(9-fluoranylundecyl)phenyl]-5-pentoxy-pyrimidine Openeye Name: 2-[4-(9-fluoroundecyl)phenyl]-5-pentoxy-pyrimidine CAS Name: 2-[4-(9-fluoroundecyl)phenyl]-5-pentoxypyrimidine IUPAC Name: 2-[4-(9-fluoroundecyl)phenyl]-5-pentoxypyrimidine Traditional Name: 5-amoxy-2-[4-(9-fluoroundecyl)phenyl]pyrimidine Formula: C26H39FN2O MolecularWeight: 414.599063

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=CN=C(N=C1)C2=CC=C(C=C2)CCCCCCCCC(CC)F

Isomeric SMILES

CCCCCOC1=CN=C(N=C1)C2=CC=C(C=C2)CCCCCCCCC(CC)F

InChI

InChI=1S/C26H39FN2O/c1-3-5-12-19-30-25-20-28-26(29-21-25)23-17-15-22(16-18-23)13-10-8-6-7-9-11-14-24(27)4-2/h15-18,20-21,24H,3-14,19H2,1-2H3