(E)-5-ethoxy-6,6,7,7,7-pentakis(fluoranyl)-1-phenyl-4-phenylsulfanyl-hept-4-en-1-yn-3-ol

Systemtic Name: (E)-5-ethoxy-6,6,7,7,7-pentakis(fluoranyl)-1-phenyl-4-phenylsulfanyl-hept-4-en-1-yn-3-ol Openeye Name: (E)-5-ethoxy-6,6,7,7,7-pentafluoro-1-phenyl-4-phenylsulfanyl-hept-4-en-1-yn-3-ol CAS Name: (E)-5-ethoxy-6,6,7,7,7-pentafluoro-1-phenyl-4-(phenylthio)-3-hept-4-en-1-ynol IUPAC Name: (E)-5-ethoxy-6,6,7,7,7-pentafluoro-1-phenyl-4-phenylsulfanylhept-4-en-1-yn-3-ol Traditional Name: (E)-5-ethoxy-6,6,7,7,7-pentafluoro-1-phenyl-4-(phenylthio)hept-4-en-1-yn-3-ol Formula: C21H17F5O2S MolecularWeight: 428.415496

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=C(C(C#CC1=CC=CC=C1)O)SC2=CC=CC=C2)C(C(F)(F)F)(F)F

Isomeric SMILES

CCO/C(=C(\C(C#CC1=CC=CC=C1)O)/SC2=CC=CC=C2)/C(C(F)(F)F)(F)F

InChI

InChI=1S/C21H17F5O2S/c1-2-28-19(20(22,23)21(24,25)26)18(29-16-11-7-4-8-12-16)17(27)14-13-15-9-5-3-6-10-15/h3-12,17,27H,2H2,1H3/b19-18+