3-Dimethylamino-1-{2-[4-(2-methoxyphenyl)butyl]phenoxy}-2-propanol hydrochloride
Basic information
- Standard SMILES
COc1ccccc1CCCCc1ccccc1OCC(O)CN(C)C.Cl- InChIKey
HZKXDXQGEQAXLS-UHFFFAOYSA-N- Molecular formula
- C22H32ClNO3
- Average molar mass
- 393.9 g/mol
- Monoisotopic mass
- 393.2070716
Names & identifiers
- Preferred name
- 3-Dimethylamino-1-{2-[4-(2-methoxyphenyl)butyl]phenoxy}-2-propanol hydrochloride
- IUPAC
- 1-(dimethylamino)-3-[2-[4-(2-methoxyphenyl)butyl]phenoxy]propan-2-ol;hydrochloride
Names & synonyms
SCHEMBL8703573HZKXDXQGEQAXLS-UHFFFAOYSA-N3-Dimethylamino-1-{2-[4-(2-methoxyphenyl)butyl]phenoxy}-2-propanol hydrochloride
Database identifiers
- PubChem CID
- 57497609
Properties
Computed structural properties
- Topological polar surface area
- 41.9 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 11
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 363
Related reactions
1 records
Compound notes
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