4-ethoxy-1,1,1-tris(fluoranyl)-4-oxidanylidene-2-thiophen-2-yl-3-triphenylphosphaniumyl-butan-2-olate

Systemtic Name: 4-ethoxy-1,1,1-tris(fluoranyl)-4-oxidanylidene-2-thiophen-2-yl-3-triphenylphosphaniumyl-butan-2-olate Openeye Name: 4-ethoxy-1,1,1-trifluoro-4-oxo-2-(2-thienyl)-3-triphenylphosphaniumyl-butan-2-olate CAS Name: 4-ethoxy-1,1,1-trifluoro-4-oxo-2-thiophen-2-yl-3-triphenylphosphiniumyl-2-butanolate IUPAC Name: 4-ethoxy-1,1,1-trifluoro-4-oxo-2-thiophen-2-yl-3-triphenylphosphaniumylbutan-2-olate Traditional Name: 4-ethoxy-1,1,1-trifluoro-4-keto-2-(2-thienyl)-3-triphenylphosphiniumyl-butan-2-olate Formula: C28H24F3O3PS MolecularWeight: 528.522331

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C(C1=CC=CS1)(C(F)(F)F)[O-])[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C(C(C1=CC=CS1)(C(F)(F)F)[O-])[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C28H24F3O3PS/c1-2-34-26(32)25(27(33,28(29,30)31)24-19-12-20-36-24)35(21-13-6-3-7-14-21,22-15-8-4-9-16-22)23-17-10-5-11-18-23/h3-20,25H,2H2,1H3