tert-butyl-chloranyl-methylsulfanyl-phenyl-phosphanium; tris(fluoranyl)methanesulfonate

Systemtic Name: tert-butyl-chloranyl-methylsulfanyl-phenyl-phosphanium; tris(fluoranyl)methanesulfonate Openeye Name: tert-butyl-chloro-methylsulfanyl-phenyl-phosphonium; trifluoromethanesulfonate CAS Name: tert-butyl-chloro-(methylthio)-phenylphosphonium; trifluoromethanesulfonate IUPAC Name: tert-butyl-chloro-methylsulfanyl-phenylphosphanium; trifluoromethanesulfonate Traditional Name: tert-butyl-chloro-(methylthio)-phenyl-phosphonium triflate Formula: C12H17ClF3O3PS2 MolecularWeight: 396.813551

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)[P+](C1=CC=CC=C1)(SC)Cl.C(F)(F)(F)S(=O)(=O)[O-]

Isomeric SMILES

CC(C)(C)[P+](C1=CC=CC=C1)(SC)Cl.C(F)(F)(F)S(=O)(=O)[O-]

InChI

InChI=1S/C11H17ClPS.CHF3O3S/c1-11(2,3)13(12,14-4)10-8-6-5-7-9-10;2-1(3,4)8(5,6)7/h5-9H,1-4H3;(H,5,6,7)/q+1;/p-1