Basic information
- Standard SMILES
Cl.O=S(=O)(CCNCc1ccccc1)c1ccccc1- InChIKey
QONXQGPFRIGJOV-UHFFFAOYSA-N- Molecular formula
- C15H18ClNO2S
- Average molar mass
- 311.8 g/mol
Names & identifiers
- Preferred name
- N-[2-(Phenylsulfonyl)ethyl]benzenemethanamine hydrochloride
- IUPAC
- 2-(benzenesulfonyl)-N-benzylethanamine;hydrochloride
Names & synonyms
SCHEMBL10683848QONXQGPFRIGJOV-UHFFFAOYSA-NN-[2-(Phenylsulfonyl)ethyl]benzenemethanamine hydrochloride
Database identifiers
- PubChem CID
- 13655083
Properties
Computed structural properties
- Topological polar surface area
- 54.6 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 6
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 336
Related reactions
2 records
Compound notes
Loading…