2-[2-[3-fluoranyl-4-(trifluoromethyloxy)phenyl]ethynyl]-7-propyl-phenanthrene

Systemtic Name: 2-[2-[3-fluoranyl-4-(trifluoromethyloxy)phenyl]ethynyl]-7-propyl-phenanthrene Openeye Name: 2-[2-[3-fluoro-4-(trifluoromethoxy)phenyl]ethynyl]-7-propyl-phenanthrene CAS Name: 2-[2-[3-fluoro-4-(trifluoromethoxy)phenyl]ethynyl]-7-propylphenanthrene IUPAC Name: 2-[2-[3-fluoro-4-(trifluoromethoxy)phenyl]ethynyl]-7-propylphenanthrene Traditional Name: 2-[2-[3-fluoro-4-(trifluoromethoxy)phenyl]ethynyl]-7-propyl-phenanthrene Formula: C26H18F4O MolecularWeight: 422.414133

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC2=C(C=C1)C3=C(C=C2)C=C(C=C3)C#CC4=CC(=C(C=C4)OC(F)(F)F)F

Isomeric SMILES

CCCC1=CC2=C(C=C1)C3=C(C=C2)C=C(C=C3)C#CC4=CC(=C(C=C4)OC(F)(F)F)F

InChI

InChI=1S/C26H18F4O/c1-2-3-17-6-11-22-20(14-17)9-10-21-15-18(7-12-23(21)22)4-5-19-8-13-25(24(27)16-19)31-26(28,29)30/h6-16H,2-3H2,1H3