Basic information
- Standard SMILES
CS(=O)(=O)Nc1ccc(CCOc2ccc(C=O)cc2)cc1- InChIKey
KPLZTJGUAIOSTK-UHFFFAOYSA-N- Molecular formula
- C16H17NO4S
- Average molar mass
- 319.4 g/mol
Names & identifiers
- Preferred name
- N-{4-[2-(4-formylphenoxy)ethyl]phenyl}methanesulfonamide
- IUPAC
- N-[4-[2-(4-formylphenoxy)ethyl]phenyl]methanesulfonamide
Names & synonyms
SCHEMBL8000730KPLZTJGUAIOSTK-UHFFFAOYSA-NN-{4-[2-(4-formylphenoxy)ethyl]phenyl}methanesulfonamide
Database identifiers
- PubChem CID
- 21704959
Properties
Computed structural properties
- XLogP
- 2.3
- Topological polar surface area
- 80.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 7
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 430
Related reactions
4 records
Compound notes
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