4-triphenylphosphaniumylbutane-1-sulfonate

Systemtic Name: 4-triphenylphosphaniumylbutane-1-sulfonate Openeye Name: 4-triphenylphosphaniumylbutane-1-sulfonate CAS Name: 4-triphenylphosphiniumyl-1-butanesulfonate IUPAC Name: 4-triphenylphosphaniumylbutane-1-sulfonate Traditional Name: 4-triphenylphosphiniumylbutane-1-sulfonate Formula: C22H23O3PS MolecularWeight: 398.454981

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)[P+](CCCCS(=O)(=O)[O-])(C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)[P+](CCCCS(=O)(=O)[O-])(C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C22H23O3PS/c23-27(24,25)19-11-10-18-26(20-12-4-1-5-13-20,21-14-6-2-7-15-21)22-16-8-3-9-17-22/h1-9,12-17H,10-11,18-19H2