N-tert-butyl-1-(2-diphenylphosphanylcyclopenten-1-yl)methanimine; palladium(2+); propane; tris(fluoranyl)methanesulfonate

Systemtic Name: N-tert-butyl-1-(2-diphenylphosphanylcyclopenten-1-yl)methanimine; palladium(2+); propane; tris(fluoranyl)methanesulfonate Openeye Name: N-tert-butyl-1-(2-diphenylphosphanylcyclopenten-1-yl)methanimine; palladium(2+); propane; trifluoromethanesulfonate CAS Name: N-tert-butyl-1-(2-diphenylphosphino-1-cyclopentenyl)methanimine; palladium(2+); propane; trifluoromethanesulfonate IUPAC Name: N-tert-butyl-1-(2-diphenylphosphanylcyclopenten-1-yl)methanimine; palladium(2+); propane; trifluoromethanesulfonate Traditional Name: tert-butyl-[(2-diphenylphosphinocyclopenten-1-yl)methylene]amine; palladium(2+); propane; triflate Formula: C26H31F3NO3PPdS+ MolecularWeight: 631.983211

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)N=CC1=C(CCC1)P(C2=CC=CC=C2)C3=CC=CC=C3.[CH2][CH][CH2].C(F)(F)(F)S(=O)(=O)[O-].[Pd+2]

Isomeric SMILES

CC(C)(C)N=CC1=C(CCC1)P(C2=CC=CC=C2)C3=CC=CC=C3.[CH2][CH][CH2].C(F)(F)(F)S(=O)(=O)[O-].[Pd+2]

InChI

InChI=1S/C22H26NP.C3H5.CHF3O3S.Pd/c1-22(2,3)23-17-18-11-10-16-21(18)24(19-12-6-4-7-13-19)20-14-8-5-9-15-20;1-3-2;2-1(3,4)8(5,6)7;/h4-9,12-15,17H,10-11,16H2,1-3H3;3H,1-2H2;(H,5,6,7);/q;;;+2/p-1