Basic information
- Standard SMILES
COC(=O)c1cc(S(N)(=O)=O)c(OC)c2c1OCCO2- InChIKey
NVNRWKTVXWAHHF-UHFFFAOYSA-N- Molecular formula
- C11H13NO7S
- Average molar mass
- 303.29 g/mol
Names & identifiers
- Preferred name
- Methyl-8-methoxy-7-sulfamoyl-1,4-benzodioxane-5-carboxylate
- IUPAC
- methyl 5-methoxy-6-sulfamoyl-2,3-dihydro-1,4-benzodioxine-8-carboxylate
Names & synonyms
SCHEMBL11259203NVNRWKTVXWAHHF-UHFFFAOYSA-Nmethyl-8-methoxy-7-sulfamoyl-1,4-benzodioxane-5-carboxylate
Database identifiers
- PubChem CID
- 20544706
Properties
Computed structural properties
- XLogP
- 0
- Topological polar surface area
- 123 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 4
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 460
Related reactions
12 records
Compound notes
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