(3,3-dimethyl-2-methylimino-1-phenyl-butyl)-triphenyl-phosphanium; tris(fluoranyl)methanesulfonate

Systemtic Name: (3,3-dimethyl-2-methylimino-1-phenyl-butyl)-triphenyl-phosphanium; tris(fluoranyl)methanesulfonate Openeye Name: (3,3-dimethyl-2-methylimino-1-phenyl-butyl)-triphenyl-phosphonium; trifluoromethanesulfonate CAS Name: (3,3-dimethyl-2-methylimino-1-phenylbutyl)-triphenylphosphonium; trifluoromethanesulfonate IUPAC Name: (3,3-dimethyl-2-methylimino-1-phenylbutyl)-triphenylphosphanium; trifluoromethanesulfonate Traditional Name: (3,3-dimethyl-2-methylimino-1-phenyl-butyl)-triphenyl-phosphonium triflate Formula: C32H33F3NO3PS MolecularWeight: 599.643291

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=NC)C(C1=CC=CC=C1)[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4.C(F)(F)(F)S(=O)(=O)[O-]

Isomeric SMILES

CC(C)(C)C(=NC)C(C1=CC=CC=C1)[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4.C(F)(F)(F)S(=O)(=O)[O-]

InChI

InChI=1S/C31H33NP.CHF3O3S/c1-31(2,3)30(32-4)29(25-17-9-5-10-18-25)33(26-19-11-6-12-20-26,27-21-13-7-14-22-27)28-23-15-8-16-24-28;2-1(3,4)8(5,6)7/h5-24,29H,1-4H3;(H,5,6,7)/q+1;/p-1