[2-(4-bromophenyl)-2-oxidanylidene-ethyl]-diphenyl-sulfanium; butyl(triphenyl)boranuide

Systemtic Name: [2-(4-bromophenyl)-2-oxidanylidene-ethyl]-diphenyl-sulfanium; butyl(triphenyl)boranuide Openeye Name: [2-(4-bromophenyl)-2-oxo-ethyl]-diphenyl-sulfonium; butyl(triphenyl)boranuide CAS Name: [2-(4-bromophenyl)-2-oxoethyl]-diphenylsulfonium; butyl(triphenyl)boranuide IUPAC Name: [2-(4-bromophenyl)-2-oxoethyl]-diphenylsulfanium; butyl(triphenyl)boranuide Traditional Name: [2-(4-bromophenyl)-2-keto-ethyl]-diphenyl-sulfonium; butyl(triphenyl)boranuide Formula: C42H40BBrOS MolecularWeight: 683.5464

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Descriptors Computed from Structure

Canonical SMILES:

[B-](CCCC)(C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)[S+](CC(=O)C2=CC=C(C=C2)Br)C3=CC=CC=C3

Isomeric SMILES

[B-](CCCC)(C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)[S+](CC(=O)C2=CC=C(C=C2)Br)C3=CC=CC=C3

InChI

InChI=1S/C22H24B.C20H16BrOS/c1-2-3-19-23(20-13-7-4-8-14-20,21-15-9-5-10-16-21)22-17-11-6-12-18-22;21-17-13-11-16(12-14-17)20(22)15-23(18-7-3-1-4-8-18)19-9-5-2-6-10-19/h4-18H,2-3,19H2,1H3;1-14H,15H2/q-1;+1