5-bis(4-chloranyl-3-sulfo-phenyl)phosphanyl-2-chloranyl-benzenesulfonic acid

Systemtic Name: 5-bis(4-chloranyl-3-sulfo-phenyl)phosphanyl-2-chloranyl-benzenesulfonic acid Openeye Name: 5-bis(4-chloro-3-sulfo-phenyl)phosphanyl-2-chloro-benzenesulfonic acid CAS Name: 5-bis(4-chloro-3-sulfophenyl)phosphino-2-chlorobenzenesulfonic acid IUPAC Name: 5-bis(4-chloro-3-sulfophenyl)phosphanyl-2-chlorobenzenesulfonic acid Traditional Name: 5-bis(4-chloro-3-sulfo-phenyl)phosphino-2-chloro-besylic acid Formula: C18H12Cl3O9PS3 MolecularWeight: 605.810241

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1P(C2=CC(=C(C=C2)Cl)S(=O)(=O)O)C3=CC(=C(C=C3)Cl)S(=O)(=O)O)S(=O)(=O)O)Cl

Isomeric SMILES

C1=CC(=C(C=C1P(C2=CC(=C(C=C2)Cl)S(=O)(=O)O)C3=CC(=C(C=C3)Cl)S(=O)(=O)O)S(=O)(=O)O)Cl

InChI

InChI=1S/C18H12Cl3O9PS3/c19-13-4-1-10(7-16(13)32(22,23)24)31(11-2-5-14(20)17(8-11)33(25,26)27)12-3-6-15(21)18(9-12)34(28,29)30/h1-9H,(H,22,23,24)(H,25,26,27)(H,28,29,30)