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

Systemtic Name: 2-[2,3-bis(fluoranyl)-4-(4-fluoranylpentyl)phenyl]-5-octoxy-pyrimidine Openeye Name: 2-[2,3-difluoro-4-(4-fluoropentyl)phenyl]-5-octoxy-pyrimidine CAS Name: 2-[2,3-difluoro-4-(4-fluoropentyl)phenyl]-5-octoxypyrimidine IUPAC Name: 2-[2,3-difluoro-4-(4-fluoropentyl)phenyl]-5-octoxypyrimidine Traditional Name: 2-[2,3-difluoro-4-(4-fluoropentyl)phenyl]-5-octoxy-pyrimidine Formula: C23H31F3N2O MolecularWeight: 408.50025

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H31F3N2O/c1-3-4-5-6-7-8-14-29-19-15-27-23(28-16-19)20-13-12-18(21(25)22(20)26)11-9-10-17(2)24/h12-13,15-17H,3-11,14H2,1-2H3