Basic information
- Standard SMILES
CC(=O)c1cc(S(=O)(=O)c2ccccc2)ccc1OCc1ccccc1- InChIKey
CMXULFDXBDYHHR-UHFFFAOYSA-N- Molecular formula
- C21H18O4S
- Average molar mass
- 366.4 g/mol
Names & identifiers
- Preferred name
- 1-(5-Benzenesulfonyl-2-benzyloxy-phenyl)-ethanone
- IUPAC
- 1-[5-(benzenesulfonyl)-2-phenylmethoxyphenyl]ethanone
Names & synonyms
SCHEMBL3148800CMXULFDXBDYHHR-UHFFFAOYSA-N1-(5-benzenesulfonyl-2-benzyloxy-phenyl)-ethanone
Database identifiers
- PubChem CID
- 59710889
Properties
Computed structural properties
- XLogP
- 3.9
- Topological polar surface area
- 68.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 6
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 553
Related reactions
3 records
Compound notes
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