2-[3-fluoranyl-4-[2,2,3,3,4,4-hexakis(fluoranyl)-4-[1,1,2,2,3,3,4,4-octakis(fluoranyl)-4-[1,1,2,2,3,3,4,4,4-nonakis(fluoranyl)butoxy]butoxy]butoxy]phenyl]-5-(3-fluoranylhexoxy)pyrimidine

Systemtic Name: 2-[3-fluoranyl-4-[2,2,3,3,4,4-hexakis(fluoranyl)-4-[1,1,2,2,3,3,4,4-octakis(fluoranyl)-4-[1,1,2,2,3,3,4,4,4-nonakis(fluoranyl)butoxy]butoxy]butoxy]phenyl]-5-(3-fluoranylhexoxy)pyrimidine Openeye Name: 2-[3-fluoro-4-[2,2,3,3,4,4-hexafluoro-4-[1,1,2,2,3,3,4,4-octafluoro-4-(1,1,2,2,3,3,4,4,4-nonafluorobutoxy)butoxy]butoxy]phenyl]-5-(3-fluorohexoxy)pyrimidine CAS Name: 2-[3-fluoro-4-[2,2,3,3,4,4-hexafluoro-4-[1,1,2,2,3,3,4,4-octafluoro-4-(1,1,2,2,3,3,4,4,4-nonafluorobutoxy)butoxy]butoxy]phenyl]-5-(3-fluorohexoxy)pyrimidine IUPAC Name: 2-[3-fluoro-4-[2,2,3,3,4,4-hexafluoro-4-[1,1,2,2,3,3,4,4-octafluoro-4-(1,1,2,2,3,3,4,4,4-nonafluorobutoxy)butoxy]butoxy]phenyl]-5-(3-fluorohexoxy)pyrimidine Traditional Name: 2-[3-fluoro-4-[2,2,3,3,4,4-hexafluoro-4-[1,1,2,2,3,3,4,4-octafluoro-4-(1,1,2,2,3,3,4,4,4-nonafluorobutoxy)butoxy]butoxy]phenyl]-5-(3-fluorohexoxy)pyrimidine Formula: C28H19F25N2O4 MolecularWeight: 922.42154

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(CCOC1=CN=C(N=C1)C2=CC(=C(C=C2)OCC(C(C(OC(C(C(C(OC(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)F)F

Isomeric SMILES

CCCC(CCOC1=CN=C(N=C1)C2=CC(=C(C=C2)OCC(C(C(OC(C(C(C(OC(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)F)F

InChI

InChI=1S/C28H19F25N2O4/c1-2-3-13(29)6-7-56-14-9-54-17(55-10-14)12-4-5-16(15(30)8-12)57-11-18(31,32)19(33,34)25(46,47)58-27(50,51)22(39,40)23(41,42)28(52,53)59-26(48,49)21(37,38)20(35,36)24(43,44)45/h4-5,8-10,13H,2-3,6-7,11H2,1H3