Basic information
- Standard SMILES
O=C(O)c1cc(S(=O)(=O)NC2CCCCC2)cc2c1OCCO2- InChIKey
AYXQAJKNYRJXCB-UHFFFAOYSA-N- Molecular formula
- C15H19NO6S
- Average molar mass
- 341.4 g/mol
Names & identifiers
- Preferred name
- 7-Cyclohexylsulfamoyl-1,4-benzodioxane-5-carboxylic acid
- IUPAC
- 7-(cyclohexylsulfamoyl)-2,3-dihydro-1,4-benzodioxine-5-carboxylic acid
Names & synonyms
SCHEMBL11264340AYXQAJKNYRJXCB-UHFFFAOYSA-N7-cyclohexylsulfamoyl-1,4-benzodioxane-5-carboxylic acid
Database identifiers
- PubChem CID
- 20544749
Properties
Computed structural properties
- XLogP
- 1.9
- Topological polar surface area
- 110 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 4
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 525
Related reactions
12 records
Compound notes
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