2-[3-bis(2-sulfophenyl)phosphanylpropyl-(2-sulfophenyl)phosphanyl]benzenesulfonic acid

Systemtic Name: 2-[3-bis(2-sulfophenyl)phosphanylpropyl-(2-sulfophenyl)phosphanyl]benzenesulfonic acid Openeye Name: 2-[3-bis(2-sulfophenyl)phosphanylpropyl-(2-sulfophenyl)phosphanyl]benzenesulfonic acid CAS Name: 2-[3-bis(2-sulfophenyl)phosphinopropyl-(2-sulfophenyl)phosphino]benzenesulfonic acid IUPAC Name: 2-[3-bis(2-sulfophenyl)phosphanylpropyl-(2-sulfophenyl)phosphanyl]benzenesulfonic acid Traditional Name: 2-[3-bis(2-sulfophenyl)phosphinopropyl-(2-sulfophenyl)phosphino]besylic acid Formula: C27H26O12P2S4 MolecularWeight: 732.695662

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)P(CCCP(C2=CC=CC=C2S(=O)(=O)O)C3=CC=CC=C3S(=O)(=O)O)C4=CC=CC=C4S(=O)(=O)O)S(=O)(=O)O

Isomeric SMILES

C1=CC=C(C(=C1)P(CCCP(C2=CC=CC=C2S(=O)(=O)O)C3=CC=CC=C3S(=O)(=O)O)C4=CC=CC=C4S(=O)(=O)O)S(=O)(=O)O

InChI

InChI=1S/C27H26O12P2S4/c28-42(29,30)24-14-5-1-10-20(24)40(21-11-2-6-15-25(21)43(31,32)33)18-9-19-41(22-12-3-7-16-26(22)44(34,35)36)23-13-4-8-17-27(23)45(37,38)39/h1-8,10-17H,9,18-19H2,(H,28,29,30)(H,31,32,33)(H,34,35,36)(H,37,38,39)