sodium 4-diphenylphosphanylbutane-1-sulfonate

Systemtic Name: sodium 4-diphenylphosphanylbutane-1-sulfonate Openeye Name: sodium 4-diphenylphosphanylbutane-1-sulfonate CAS Name: sodium 4-diphenylphosphino-1-butanesulfonate IUPAC Name: sodium 4-diphenylphosphanylbutane-1-sulfonate Traditional Name: sodium 4-diphenylphosphinobutane-1-sulfonate Formula: C16H18NaO3PS MolecularWeight: 344.340851

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H19O3PS.Na/c17-21(18,19)14-8-7-13-20(15-9-3-1-4-10-15)16-11-5-2-6-12-16;/h1-6,9-12H,7-8,13-14H2,(H,17,18,19);/q;+1/p-1