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5-octyl-2-[2-[4-(trifluoromethyloxy)phenyl]ethynyl]pyrimidine

5-octyl-2-[2-[4-(trifluoromethyloxy)phenyl]ethynyl]pyrimidine

Systemtic Name:5-octyl-2-[2-[4-(trifluoromethyloxy)phenyl]ethynyl]pyrimidine
Openeye Name:5-octyl-2-[2-[4-(trifluoromethoxy)phenyl]ethynyl]pyrimidine
CAS Name:5-octyl-2-[2-[4-(trifluoromethoxy)phenyl]ethynyl]pyrimidine
IUPAC Name:5-octyl-2-[2-[4-(trifluoromethoxy)phenyl]ethynyl]pyrimidine
Traditional Name:5-octyl-2-[2-[4-(trifluoromethoxy)phenyl]ethynyl]pyrimidine
Formula: C21H23F3N2O
MolecularWeight: 376.41533
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=CN=C(N=C1)C#CC2=CC=C(C=C2)OC(F)(F)F


Isomeric SMILES

CCCCCCCCC1=CN=C(N=C1)C#CC2=CC=C(C=C2)OC(F)(F)F


InChI

InChI=1S/C21H23F3N2O/c1-2-3-4-5-6-7-8-18-15-25-20(26-16-18)14-11-17-9-12-19(13-10-17)27-21(22,23)24/h9-10,12-13,15-16H,2-8H2,1H3


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