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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=C(C(=C(C=C1)C2=NC=C(C=N2)CCCC(C)F)F)F

Isomeric SMILES

CCCCCCCCOC1=C(C(=C(C=C1)C2=NC=C(C=N2)CCCC(C)F)F)F

InChI

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