sodium 3,6-bis(diphenylphosphanyl)-2-phenyl-benzenesulfonate

Systemtic Name: sodium 3,6-bis(diphenylphosphanyl)-2-phenyl-benzenesulfonate Openeye Name: sodium 3,6-bis(diphenylphosphanyl)-2-phenyl-benzenesulfonate CAS Name: sodium 3,6-bis(diphenylphosphino)-2-phenylbenzenesulfonate IUPAC Name: sodium 3,6-bis(diphenylphosphanyl)-2-phenylbenzenesulfonate Traditional Name: sodium 3,6-bis(diphenylphosphino)-2-phenyl-besylate Formula: C36H27NaO3P2S MolecularWeight: 624.600072

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(C=CC(=C2S(=O)(=O)[O-])P(C3=CC=CC=C3)C4=CC=CC=C4)P(C5=CC=CC=C5)C6=CC=CC=C6.[Na+]

Isomeric SMILES

C1=CC=C(C=C1)C2=C(C=CC(=C2S(=O)(=O)[O-])P(C3=CC=CC=C3)C4=CC=CC=C4)P(C5=CC=CC=C5)C6=CC=CC=C6.[Na+]

InChI

InChI=1S/C36H28O3P2S.Na/c37-42(38,39)36-34(41(31-22-12-4-13-23-31)32-24-14-5-15-25-32)27-26-33(35(36)28-16-6-1-7-17-28)40(29-18-8-2-9-19-29)30-20-10-3-11-21-30;/h1-27H,(H,37,38,39);/q;+1/p-1