Basic information
- Standard SMILES
COc1ccc(CC(C)(C)NCC(O)COc2ccccc2Cl)cc1.Cl- InChIKey
WCYGWBMFXZJSKR-UHFFFAOYSA-N- Molecular formula
- C20H27Cl2NO3
- Average molar mass
- 400.3 g/mol
Names & identifiers
- Preferred name
- N-[2-Hydroxy-3-(2-chlorophenoxy)propyl]-1,1-dimethyl-2-(4-methoxyphenyl)ethylamine Hydrochloride
- IUPAC
- 1-(2-chlorophenoxy)-3-[[1-(4-methoxyphenyl)-2-methylpropan-2-yl]amino]propan-2-ol;hydrochloride
Names & synonyms
SCHEMBL5512987WCYGWBMFXZJSKR-UHFFFAOYSA-NN-[2-Hydroxy-3-(2-chlorophenoxy)propyl]-1,1-dimethyl-2-(4-methoxyphenyl)-ethylamine HydrochlorideN-[2-Hydroxy-3-(2-chlorophenoxy)propyl]-1,1-dimethyl-2-(4-methoxyphenyl)ethylamine Hydrochloride
Database identifiers
- PubChem CID
- 22640862
Properties
Computed structural properties
- Topological polar surface area
- 50.7 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 9
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 372
Related reactions
4 records
Compound notes
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