Basic information
- Standard SMILES
COC(=O)[C@H]1C[C@@H](O)CN1C(=O)c1ccccc1- InChIKey
QEQGWOLBDNOSAD-GHMZBOCLSA-N- Molecular formula
- C13H15NO4
- Average molar mass
- 249.26 g/mol
- Monoisotopic mass
- 249.10010796
Names & identifiers
- Preferred name
- n-Benzoyl-cis-4-hydroxy-d-proline methyl ester
- IUPAC
- methyl (2R,4R)-1-benzoyl-4-hydroxypyrrolidine-2-carboxylate
Names & synonyms
SCHEMBL6196385QEQGWOLBDNOSAD-GHMZBOCLSA-Nn-benzoyl-cis-4-hydroxy-d-proline methyl ester
Database identifiers
- PubChem CID
- 1476248
Properties
Computed structural properties
- XLogP
- 0.9
- Topological polar surface area
- 66.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 325
Related reactions
2 records
Compound notes
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