1-octyl-4-[4-[2-[4-(trifluoromethyloxy)phenyl]ethynyl]cyclohexyl]benzene

Systemtic Name: 1-octyl-4-[4-[2-[4-(trifluoromethyloxy)phenyl]ethynyl]cyclohexyl]benzene Openeye Name: 1-octyl-4-[4-[2-[4-(trifluoromethoxy)phenyl]ethynyl]cyclohexyl]benzene CAS Name: 1-octyl-4-[4-[2-[4-(trifluoromethoxy)phenyl]ethynyl]cyclohexyl]benzene IUPAC Name: 1-octyl-4-[4-[2-[4-(trifluoromethoxy)phenyl]ethynyl]cyclohexyl]benzene Traditional Name: 1-octyl-4-[4-[2-[4-(trifluoromethoxy)phenyl]ethynyl]cyclohexyl]benzene Formula: C29H35F3O MolecularWeight: 456.58281

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=CC=C(C=C1)C2CCC(CC2)C#CC3=CC=C(C=C3)OC(F)(F)F

Isomeric SMILES

CCCCCCCCC1=CC=C(C=C1)C2CCC(CC2)C#CC3=CC=C(C=C3)OC(F)(F)F

InChI

InChI=1S/C29H35F3O/c1-2-3-4-5-6-7-8-23-11-17-26(18-12-23)27-19-13-24(14-20-27)9-10-25-15-21-28(22-16-25)33-29(30,31)32/h11-12,15-18,21-22,24,27H,2-8,13-14,19-20H2,1H3