6,8-bis(fluoranyl)-1-[3-fluoranyl-4-(trifluoromethyloxy)phenyl]-2-[(E)-pent-1-enyl]-1,2,3,4,4a,9,10,10a-octahydrophenanthrene

Systemtic Name: 6,8-bis(fluoranyl)-1-[3-fluoranyl-4-(trifluoromethyloxy)phenyl]-2-[(E)-pent-1-enyl]-1,2,3,4,4a,9,10,10a-octahydrophenanthrene Openeye Name: 6,8-difluoro-1-[3-fluoro-4-(trifluoromethoxy)phenyl]-2-[(E)-pent-1-enyl]-1,2,3,4,4a,9,10,10a-octahydrophenanthrene CAS Name: 6,8-difluoro-1-[3-fluoro-4-(trifluoromethoxy)phenyl]-2-[(E)-pent-1-enyl]-1,2,3,4,4a,9,10,10a-octahydrophenanthrene IUPAC Name: 6,8-difluoro-1-[3-fluoro-4-(trifluoromethoxy)phenyl]-2-[(E)-pent-1-enyl]-1,2,3,4,4a,9,10,10a-octahydrophenanthrene Traditional Name: 6,8-difluoro-1-[3-fluoro-4-(trifluoromethoxy)phenyl]-2-[(E)-pent-1-enyl]-1,2,3,4,4a,9,10,10a-octahydrophenanthrene Formula: C26H26F6O MolecularWeight: 468.474459

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Descriptors Computed from Structure

Canonical SMILES:

CCCC=CC1CCC2C(C1C3=CC(=C(C=C3)OC(F)(F)F)F)CCC4=C(C=C(C=C24)F)F

Isomeric SMILES

CCC/C=C/C1CCC2C(C1C3=CC(=C(C=C3)OC(F)(F)F)F)CCC4=C(C=C(C=C24)F)F

InChI

InChI=1S/C26H26F6O/c1-2-3-4-5-15-6-8-18-20(10-9-19-21(18)13-17(27)14-22(19)28)25(15)16-7-11-24(23(29)12-16)33-26(30,31)32/h4-5,7,11-15,18,20,25H,2-3,6,8-10H2,1H3/b5-4+