2-[4-(7-cyclopentylheptoxy)-2,3-bis(fluoranyl)phenyl]-5-octoxy-pyrimidine

Systemtic Name: 2-[4-(7-cyclopentylheptoxy)-2,3-bis(fluoranyl)phenyl]-5-octoxy-pyrimidine Openeye Name: 2-[4-(7-cyclopentylheptoxy)-2,3-difluoro-phenyl]-5-octoxy-pyrimidine CAS Name: 2-[4-(7-cyclopentylheptoxy)-2,3-difluorophenyl]-5-octoxypyrimidine IUPAC Name: 2-[4-(7-cyclopentylheptoxy)-2,3-difluorophenyl]-5-octoxypyrimidine Traditional Name: 2-[4-(7-cyclopentylheptoxy)-2,3-difluoro-phenyl]-5-octoxy-pyrimidine Formula: C30H44F2N2O2 MolecularWeight: 502.679366

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=CN=C(N=C1)C2=C(C(=C(C=C2)OCCCCCCCC3CCCC3)F)F

Isomeric SMILES

CCCCCCCCOC1=CN=C(N=C1)C2=C(C(=C(C=C2)OCCCCCCCC3CCCC3)F)F

InChI

InChI=1S/C30H44F2N2O2/c1-2-3-4-5-8-13-20-35-25-22-33-30(34-23-25)26-18-19-27(29(32)28(26)31)36-21-14-9-6-7-10-15-24-16-11-12-17-24/h18-19,22-24H,2-17,20-21H2,1H3