Basic information
- Standard SMILES
CS(=O)(=O)OCC(OS(C)(=O)=O)c1ccc2cnn(Cc3ccccc3)c2c1- InChIKey
OQMPATBDKSNPTJ-UHFFFAOYSA-N- Molecular formula
- C18H20N2O6S2
- Average molar mass
- 424.5 g/mol
Names & identifiers
- Preferred name
- Methanesulfonic acid 2-(1-benzyl-1H-indazol-6-yl)-2-methanesulfonyloxy-ethyl ester
- IUPAC
- [2-(1-benzylindazol-6-yl)-2-methylsulfonyloxyethyl] methanesulfonate
Names & synonyms
SCHEMBL2542925OQMPATBDKSNPTJ-UHFFFAOYSA-NMethanesulfonic acid 2-(1-benzyl-1H-indazol-6-yl)-2-methanesulfonyloxy-ethyl ester
Database identifiers
- PubChem CID
- 76800943
Properties
Computed structural properties
- XLogP
- 1.8
- Topological polar surface area
- 121 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 8
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 709
Related reactions
4 records
Compound notes
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