Basic information
- Standard SMILES
COC(=O)COC/C=C\CN1C(=O)CCC[C@@H]1/C=C/C(O)Cc1ccccc1- InChIKey
QUEZFBZMPJZXMY-SMNRKCEYSA-N- Molecular formula
- C22H29NO5
- Average molar mass
- 387.5 g/mol
Names & identifiers
- Preferred name
- {(Z)-4-[(R)-2-((E)-3-Hydroxy-4-phenyl-but-1-enyl)-6-oxo-piperidin-1-yl]-but-2-enyloxy}-acetic acid methyl ester
- IUPAC
- methyl 2-[(Z)-4-[(2R)-2-[(E)-3-hydroxy-4-phenylbut-1-enyl]-6-oxopiperidin-1-yl]but-2-enoxy]acetate
Names & synonyms
SCHEMBL1379020QUEZFBZMPJZXMY-SMNRKCEYSA-N{(Z)-4-[(R)-2-((E)-3-Hydroxy-4-phenyl-but-1-enyl)-6-oxo-piperidin-1-yl]-but-2-enyloxy}-acetic acid methyl ester
Database identifiers
- PubChem CID
- 11234591
Properties
Computed structural properties
- XLogP
- 1.9
- Topological polar surface area
- 76.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 11
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 539
Related reactions
3 records
Compound notes
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