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

Systemtic Name: 2-[2,3-bis(fluoranyl)-4-(4-fluoranylpentyl)phenyl]-5-octyl-pyrimidine Openeye Name: 2-[2,3-difluoro-4-(4-fluoropentyl)phenyl]-5-octyl-pyrimidine CAS Name: 2-[2,3-difluoro-4-(4-fluoropentyl)phenyl]-5-octylpyrimidine IUPAC Name: 2-[2,3-difluoro-4-(4-fluoropentyl)phenyl]-5-octylpyrimidine Traditional Name: 2-[2,3-difluoro-4-(4-fluoropentyl)phenyl]-5-octyl-pyrimidine Formula: C23H31F3N2 MolecularWeight: 392.50085

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=CN=C(N=C1)C2=C(C(=C(C=C2)CCCC(C)F)F)F

Isomeric SMILES

CCCCCCCCC1=CN=C(N=C1)C2=C(C(=C(C=C2)CCCC(C)F)F)F

InChI

InChI=1S/C23H31F3N2/c1-3-4-5-6-7-8-11-18-15-27-23(28-16-18)20-14-13-19(21(25)22(20)26)12-9-10-17(2)24/h13-17H,3-12H2,1-2H3