Basic information
- Standard SMILES
COc1cc(O)cc(OC)c1/C=C/S(=O)(=O)CS(=O)(=O)/C=C/c1c(OC)cc(O)cc1OC- InChIKey
JGIFRCVWDMXRRD-KQQUZDAGSA-N- Molecular formula
- C21H24O10S2
- Average molar mass
- 500.5 g/mol
Names & identifiers
- Preferred name
- 4-((1E)-2-(((E)-4-hydroxy-2,6-dimethoxystyrylsulfonyl)methylsulfonyl)vinyl)-3,5-dimethoxyphenol
- IUPAC
- 4-[(E)-2-[[(E)-2-(4-hydroxy-2,6-dimethoxyphenyl)ethenyl]sulfonylmethylsulfonyl]ethenyl]-3,5-dimethoxyphenol
Names & synonyms
SCHEMBL1323497JGIFRCVWDMXRRD-KQQUZDAGSA-N4-((1E)-2-(((E)-4-hydroxy-2,6-dimethoxystyrylsulfonyl)methylsulfonyl)vinyl)-3,5-dimethoxyphenol
Database identifiers
- PubChem CID
- 11620311
Properties
Computed structural properties
- XLogP
- 2.2
- Topological polar surface area
- 162 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 10
- Rotatable bonds
- 10
- Heavy atoms
- 33
- Formal charge
- 0
- Complexity
- 772
Related reactions
1 records
Compound notes
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