[5-oxidanylidene-5-(phenylsulfonylamino)pentyl]-triphenyl-phosphanium bromide

Systemtic Name: [5-oxidanylidene-5-(phenylsulfonylamino)pentyl]-triphenyl-phosphanium bromide Openeye Name: [5-(benzenesulfonamido)-5-oxo-pentyl]-triphenyl-phosphonium bromide CAS Name: [5-(benzenesulfonamido)-5-oxopentyl]-triphenylphosphonium bromide IUPAC Name: [5-(benzenesulfonamido)-5-oxopentyl]-triphenylphosphanium bromide Traditional Name: [5-(benzenesulfonamido)-5-keto-pentyl]-triphenyl-phosphonium bromide Formula: C29H29BrNO3PS MolecularWeight: 582.488221

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)[P+](CCCCC(=O)NS(=O)(=O)C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4.[Br-]

Isomeric SMILES

C1=CC=C(C=C1)[P+](CCCCC(=O)NS(=O)(=O)C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4.[Br-]

InChI

InChI=1S/C29H28NO3PS.BrH/c31-29(30-35(32,33)28-21-11-4-12-22-28)23-13-14-24-34(25-15-5-1-6-16-25,26-17-7-2-8-18-26)27-19-9-3-10-20-27;/h1-12,15-22H,13-14,23-24H2;1H