dibutyl-[2-oxidanylidene-2-(4-phenylphenyl)ethyl]sulfanium bromide

Systemtic Name: dibutyl-[2-oxidanylidene-2-(4-phenylphenyl)ethyl]sulfanium bromide Openeye Name: dibutyl-[2-oxo-2-(4-phenylphenyl)ethyl]sulfonium bromide CAS Name: dibutyl-[2-oxo-2-(4-phenylphenyl)ethyl]sulfonium bromide IUPAC Name: dibutyl-[2-oxo-2-(4-phenylphenyl)ethyl]sulfanium bromide Traditional Name: dibutyl-[2-keto-2-(4-phenylphenyl)ethyl]sulfonium bromide Formula: C22H29BrOS MolecularWeight: 421.43406

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H29OS.BrH/c1-3-5-16-24(17-6-4-2)18-22(23)21-14-12-20(13-15-21)19-10-8-7-9-11-19;/h7-15H,3-6,16-18H2,1-2H3;1H/q+1;/p-1