2-chloranyl-5-methyl-1-[(2-methylpropan-2-yl)oxy]-1-oxidanylidene-3-(trifluoromethyl)-2-triphenylphosphaniumyl-hexan-3-olate

Systemtic Name: 2-chloranyl-5-methyl-1-[(2-methylpropan-2-yl)oxy]-1-oxidanylidene-3-(trifluoromethyl)-2-triphenylphosphaniumyl-hexan-3-olate Openeye Name: 1-tert-butoxy-2-chloro-5-methyl-1-oxo-3-(trifluoromethyl)-2-triphenylphosphaniumyl-hexan-3-olate CAS Name: 2-chloro-5-methyl-1-[(2-methylpropan-2-yl)oxy]-1-oxo-3-(trifluoromethyl)-2-triphenylphosphiniumyl-3-hexanolate IUPAC Name: 2-chloro-5-methyl-1-[(2-methylpropan-2-yl)oxy]-1-oxo-3-(trifluoromethyl)-2-triphenylphosphaniumylhexan-3-olate Traditional Name: 1-tert-butoxy-2-chloro-1-keto-5-methyl-3-(trifluoromethyl)-2-triphenylphosphiniumyl-hexan-3-olate Formula: C30H33ClF3O3P MolecularWeight: 565.003191

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(C(=O)OC(C)(C)C)([P+](C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3)Cl)(C(F)(F)F)[O-]

Isomeric SMILES

CC(C)CC(C(C(=O)OC(C)(C)C)([P+](C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3)Cl)(C(F)(F)F)[O-]

InChI

InChI=1S/C30H33ClF3O3P/c1-22(2)21-28(36,30(32,33)34)29(31,26(35)37-27(3,4)5)38(23-15-9-6-10-16-23,24-17-11-7-12-18-24)25-19-13-8-14-20-25/h6-20,22H,21H2,1-5H3