2-[4-(3-fluoranyloctoxy)phenyl]-5-heptoxy-pyrimidine

Systemtic Name: 2-[4-(3-fluoranyloctoxy)phenyl]-5-heptoxy-pyrimidine Openeye Name: 2-[4-(3-fluorooctoxy)phenyl]-5-heptoxy-pyrimidine CAS Name: 2-[4-(3-fluorooctoxy)phenyl]-5-heptoxypyrimidine IUPAC Name: 2-[4-(3-fluorooctoxy)phenyl]-5-heptoxypyrimidine Traditional Name: 2-[4-(3-fluorooctoxy)phenyl]-5-heptoxy-pyrimidine Formula: C25H37FN2O2 MolecularWeight: 416.571883

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC1=CN=C(N=C1)C2=CC=C(C=C2)OCCC(CCCCC)F

Isomeric SMILES

CCCCCCCOC1=CN=C(N=C1)C2=CC=C(C=C2)OCCC(CCCCC)F

InChI

InChI=1S/C25H37FN2O2/c1-3-5-7-8-10-17-29-24-19-27-25(28-20-24)21-12-14-23(15-13-21)30-18-16-22(26)11-9-6-4-2/h12-15,19-20,22H,3-11,16-18H2,1-2H3