trisodium; 3-bis(3-sulfonatophenyl)phosphanylbenzenesulfonate; gold(1+); pyridine-2-thiolate

Systemtic Name: trisodium; 3-bis(3-sulfonatophenyl)phosphanylbenzenesulfonate; gold(1+); pyridine-2-thiolate Openeye Name: trisodium; 3-bis(3-sulfonatophenyl)phosphanylbenzenesulfonate; gold(1+); pyridine-2-thiolate CAS Name: trisodium; 3-bis(3-sulfonatophenyl)phosphinobenzenesulfonate; gold(1+); 2-pyridinethiolate IUPAC Name: trisodium; 3-bis(3-sulfonatophenyl)phosphanylbenzenesulfonate; gold(1+); pyridine-2-thiolate Traditional Name: trisodium; 3-bis(3-sulfonatophenyl)phosphinobesylate; gold(1+); pyridine-2-thiolate Formula: C23H16AuNNa3O9PS4 MolecularWeight: 875.544061

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=NC(=C1)[S-].C1=CC(=CC(=C1)S(=O)(=O)[O-])P(C2=CC(=CC=C2)S(=O)(=O)[O-])C3=CC(=CC=C3)S(=O)(=O)[O-].[Na+].[Na+].[Na+].[Au+]

Isomeric SMILES

C1=CC=NC(=C1)[S-].C1=CC(=CC(=C1)S(=O)(=O)[O-])P(C2=CC(=CC=C2)S(=O)(=O)[O-])C3=CC(=CC=C3)S(=O)(=O)[O-].[Na+].[Na+].[Na+].[Au+]

InChI

InChI=1S/C18H15O9PS3.C5H5NS.Au.3Na/c19-29(20,21)16-7-1-4-13(10-16)28(14-5-2-8-17(11-14)30(22,23)24)15-6-3-9-18(12-15)31(25,26)27;7-5-3-1-2-4-6-5;;;;/h1-12H,(H,19,20,21)(H,22,23,24)(H,25,26,27);1-4H,(H,6,7);;;;/q;;4*+1/p-4