triethylsulfanium; tris(4,5-diethylnaphthalen-1-yl)-octyl-boranuide

Systemtic Name: triethylsulfanium; tris(4,5-diethylnaphthalen-1-yl)-octyl-boranuide Openeye Name: triethylsulfonium; tris(4,5-diethyl-1-naphthyl)-octyl-boranuide CAS Name: triethylsulfonium; tris(4,5-diethyl-1-naphthalenyl)-octylboranuide IUPAC Name: triethylsulfanium; tris(4,5-diethylnaphthalen-1-yl)-octylboranuide Traditional Name: triethylsulfonium; tris(4,5-diethyl-1-naphthyl)-octyl-boranuide Formula: C56H77BS MolecularWeight: 793.08658

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Descriptors Computed from Structure

Canonical SMILES:

[B-](CCCCCCCC)(C1=C2C=CC=C(C2=C(C=C1)CC)CC)(C3=C4C=CC=C(C4=C(C=C3)CC)CC)C5=C6C=CC=C(C6=C(C=C5)CC)CC.CC[S+](CC)CC

Isomeric SMILES

[B-](CCCCCCCC)(C1=C2C=CC=C(C2=C(C=C1)CC)CC)(C3=C4C=CC=C(C4=C(C=C3)CC)CC)C5=C6C=CC=C(C6=C(C=C5)CC)CC.CC[S+](CC)CC

InChI

InChI=1S/C50H62B.C6H15S/c1-8-15-16-17-18-19-35-51(45-32-29-39(12-5)48-36(9-2)23-20-26-42(45)48,46-33-30-40(13-6)49-37(10-3)24-21-27-43(46)49)47-34-31-41(14-7)50-38(11-4)25-22-28-44(47)50;1-4-7(5-2)6-3/h20-34H,8-19,35H2,1-7H3;4-6H2,1-3H3/q-1;+1