3-diphenylphosphanylbenzenesulfonic acid dihydrate

Systemtic Name: 3-diphenylphosphanylbenzenesulfonic acid dihydrate Openeye Name: 3-diphenylphosphanylbenzenesulfonic acid dihydrate CAS Name: 3-diphenylphosphinobenzenesulfonic acid dihydrate IUPAC Name: 3-diphenylphosphanylbenzenesulfonic acid dihydrate Traditional Name: 3-diphenylphosphinobesylic acid dihydrate Formula: C18H19O5PS MolecularWeight: 378.379221

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC(=CC=C3)S(=O)(=O)O.O.O

Isomeric SMILES

C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC(=CC=C3)S(=O)(=O)O.O.O

InChI

InChI=1S/C18H15O3PS.2H2O/c19-23(20,21)18-13-7-12-17(14-18)22(15-8-3-1-4-9-15)16-10-5-2-6-11-16;;/h1-14H,(H,19,20,21);2*1H2