3-bis(3-sulfophenyl)phosphanylbenzenesulfonic acid; sulfane

Systemtic Name: 3-bis(3-sulfophenyl)phosphanylbenzenesulfonic acid; sulfane Openeye Name: 3-bis(3-sulfophenyl)phosphanylbenzenesulfonic acid; hydrogen sulfide CAS Name: 3-bis(3-sulfophenyl)phosphinobenzenesulfonic acid; sulfane IUPAC Name: 3-bis(3-sulfophenyl)phosphanylbenzenesulfonic acid; sulfane Traditional Name: 3-bis(3-sulfophenyl)phosphinobesylic acid; hydrogen sulfide Formula: C18H17O9PS4 MolecularWeight: 536.555941

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Descriptors Computed from Structure

Canonical SMILES:

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.S

Isomeric SMILES

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.S

InChI

InChI=1S/C18H15O9PS3.H2S/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;/h1-12H,(H,19,20,21)(H,22,23,24)(H,25,26,27);1H2