[2,6-ditert-butyl-4-[(3,5-ditert-butyl-4-phosphonooxy-phenyl)sulfanylmethylsulfanyl]phenyl] dihydrogen phosphate

Systemtic Name: [2,6-ditert-butyl-4-[(3,5-ditert-butyl-4-phosphonooxy-phenyl)sulfanylmethylsulfanyl]phenyl] dihydrogen phosphate Openeye Name: [2,6-ditert-butyl-4-[(3,5-ditert-butyl-4-phosphonooxy-phenyl)sulfanylmethylsulfanyl]phenyl] dihydrogen phosphate CAS Name: [2,6-ditert-butyl-4-[[(3,5-ditert-butyl-4-phosphonooxyphenyl)thio]methylthio]phenyl] dihydrogen phosphate IUPAC Name: [2,6-ditert-butyl-4-[(3,5-ditert-butyl-4-phosphonooxyphenyl)sulfanylmethylsulfanyl]phenyl] dihydrogen phosphate Traditional Name: [2,6-ditert-butyl-4-[[(3,5-ditert-butyl-4-phosphonooxy-phenyl)thio]methylthio]phenyl] dihydrogen phosphate Formula: C29H46O8P2S2 MolecularWeight: 648.748262

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1OP(=O)(O)O)C(C)(C)C)SCSC2=CC(=C(C(=C2)C(C)(C)C)OP(=O)(O)O)C(C)(C)C

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1OP(=O)(O)O)C(C)(C)C)SCSC2=CC(=C(C(=C2)C(C)(C)C)OP(=O)(O)O)C(C)(C)C

InChI

InChI=1S/C29H46O8P2S2/c1-26(2,3)20-13-18(14-21(27(4,5)6)24(20)36-38(30,31)32)40-17-41-19-15-22(28(7,8)9)25(37-39(33,34)35)23(16-19)29(10,11)12/h13-16H,17H2,1-12H3,(H2,30,31,32)(H2,33,34,35)