butan-2-yl-tris(4-fluorophenyl)boranuide; (4-cyanophenyl)methyl-methyl-phenyl-sulfanium

Systemtic Name: butan-2-yl-tris(4-fluorophenyl)boranuide; (4-cyanophenyl)methyl-methyl-phenyl-sulfanium Openeye Name: (4-cyanophenyl)methyl-methyl-phenyl-sulfonium; tris(4-fluorophenyl)-sec-butyl-boranuide CAS Name: butan-2-yl-tris(4-fluorophenyl)boranuide; (4-cyanophenyl)methyl-methyl-phenylsulfonium IUPAC Name: butan-2-yl-tris(4-fluorophenyl)boranuide; (4-cyanophenyl)methyl-methyl-phenylsulfanium Traditional Name: (4-cyanobenzyl)-methyl-phenyl-sulfonium; tris(4-fluorophenyl)-sec-butyl-boranuide Formula: C37H35BF3NS MolecularWeight: 593.55171

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Descriptors Computed from Structure

Canonical SMILES:

[B-](C1=CC=C(C=C1)F)(C2=CC=C(C=C2)F)(C3=CC=C(C=C3)F)C(C)CC.C[S+](CC1=CC=C(C=C1)C#N)C2=CC=CC=C2

Isomeric SMILES

[B-](C1=CC=C(C=C1)F)(C2=CC=C(C=C2)F)(C3=CC=C(C=C3)F)C(C)CC.C[S+](CC1=CC=C(C=C1)C#N)C2=CC=CC=C2

InChI

InChI=1S/C22H21BF3.C15H14NS/c1-3-16(2)23(17-4-10-20(24)11-5-17,18-6-12-21(25)13-7-18)19-8-14-22(26)15-9-19;1-17(15-5-3-2-4-6-15)12-14-9-7-13(11-16)8-10-14/h4-16H,3H2,1-2H3;2-10H,12H2,1H3/q-1;+1