Basic information
- Standard SMILES
Cl.OC1(c2ccccc2)CCN(CCC2COc3ccccc3O2)CC1- InChIKey
KYNORVVWXAWYKI-UHFFFAOYSA-N- Molecular formula
- C21H26ClNO3
- Average molar mass
- 375.9 g/mol
Names & identifiers
- Preferred name
- 2-[2-(4-Hydroxy-4-phenylpiperidino)ethyl]-1,4-benzodioxan hydrochloride
- IUPAC
- 1-[2-(2,3-dihydro-1,4-benzodioxin-3-yl)ethyl]-4-phenylpiperidin-4-ol;hydrochloride
Names & synonyms
SCHEMBL11540300KYNORVVWXAWYKI-UHFFFAOYSA-N2-[2-(4-hydroxy-4-phenylpiperidino)-ethyl]-1,4-benzodioxan hydrochloride2-[2-(4-hydroxy-4-phenylpiperidino)ethyl]-1,4-benzodioxan hydrochloride
Database identifiers
- PubChem CID
- 21332005
Properties
Computed structural properties
- Topological polar surface area
- 41.9 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 415
Related reactions
4 records
Compound notes
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