dipotassium 4-[phenyl-(4-sulfonatophenyl)phosphanyl]benzenesulfonate dihydrate

Systemtic Name: dipotassium 4-[phenyl-(4-sulfonatophenyl)phosphanyl]benzenesulfonate dihydrate Openeye Name: dipotassium 4-[phenyl-(4-sulfonatophenyl)phosphanyl]benzenesulfonate dihydrate CAS Name: dipotassium 4-[phenyl-(4-sulfonatophenyl)phosphino]benzenesulfonate dihydrate IUPAC Name: dipotassium 4-[phenyl-(4-sulfonatophenyl)phosphanyl]benzenesulfonate dihydrate Traditional Name: dipotassium 4-[phenyl-(4-sulfonatophenyl)phosphino]besylate dihydrate Formula: C18H17K2O8PS2 MolecularWeight: 534.623141

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)P(C2=CC=C(C=C2)S(=O)(=O)[O-])C3=CC=C(C=C3)S(=O)(=O)[O-].O.O.[K+].[K+]

Isomeric SMILES

C1=CC=C(C=C1)P(C2=CC=C(C=C2)S(=O)(=O)[O-])C3=CC=C(C=C3)S(=O)(=O)[O-].O.O.[K+].[K+]

InChI

InChI=1S/C18H15O6PS2.2K.2H2O/c19-26(20,21)17-10-6-15(7-11-17)25(14-4-2-1-3-5-14)16-8-12-18(13-9-16)27(22,23)24;;;;/h1-13H,(H,19,20,21)(H,22,23,24);;;2*1H2/q;2*+1;;/p-2