5-[(2,4-dimethyl-5-sulfonato-phenyl)-phenyl-phosphanyl]-2,4-dimethyl-benzenesulfonate

Systemtic Name: 5-[(2,4-dimethyl-5-sulfonato-phenyl)-phenyl-phosphanyl]-2,4-dimethyl-benzenesulfonate Openeye Name: 5-[(2,4-dimethyl-5-sulfonato-phenyl)-phenyl-phosphanyl]-2,4-dimethyl-benzenesulfonate CAS Name: 5-[(2,4-dimethyl-5-sulfonatophenyl)-phenylphosphino]-2,4-dimethylbenzenesulfonate IUPAC Name: 5-[(2,4-dimethyl-5-sulfonatophenyl)-phenylphosphanyl]-2,4-dimethylbenzenesulfonate Traditional Name: 5-[(2,4-dimethyl-5-sulfonato-phenyl)-phenyl-phosphino]-2,4-dimethyl-besylate Formula: C22H21O6PS2-2 MolecularWeight: 476.502301

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1P(C2=CC=CC=C2)C3=CC(=C(C=C3C)C)S(=O)(=O)[O-])S(=O)(=O)[O-])C

Isomeric SMILES

CC1=CC(=C(C=C1P(C2=CC=CC=C2)C3=CC(=C(C=C3C)C)S(=O)(=O)[O-])S(=O)(=O)[O-])C

InChI

InChI=1S/C22H23O6PS2/c1-14-10-16(3)21(30(23,24)25)12-19(14)29(18-8-6-5-7-9-18)20-13-22(31(26,27)28)17(4)11-15(20)2/h5-13H,1-4H3,(H,23,24,25)(H,26,27,28)/p-2