Basic information
- Standard SMILES
CCOC(=O)CO[C@@](C)(c1cccc(Cl)c1)[C@@H]1CCCNC1- InChIKey
KFYIYOYGNFOJHQ-PBHICJAKSA-N- Molecular formula
- C17H24ClNO3
- Average molar mass
- 325.8 g/mol
- Monoisotopic mass
- 325.1444713
Names & identifiers
- Preferred name
- ethyl 2-((R)-1-(3-chlorophenyl)-1-((R)-piperidin-3-yl)ethoxy)acetate
- IUPAC
- ethyl 2-[(1R)-1-(3-chlorophenyl)-1-[(3R)-piperidin-3-yl]ethoxy]acetate
Names & synonyms
SCHEMBL3615420KFYIYOYGNFOJHQ-PBHICJAKSA-Nethyl 2-((R)-1-(3-chlorophenyl)-1-((R)-piperidin-3-yl)ethoxy)acetate
Database identifiers
- PubChem CID
- 59201559
Properties
Computed structural properties
- XLogP
- 3
- Topological polar surface area
- 47.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 7
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 366
Related reactions
2 records
Compound notes
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