Basic information
- Standard SMILES
CCCCCC(=O)C=CC1CCC(=O)N1CC=CCOCC(=O)OCC- InChIKey
JGQLIEAYGPAQBH-UHFFFAOYSA-N- Molecular formula
- C20H31NO5
- Average molar mass
- 365.5 g/mol
- Monoisotopic mass
- 365.22022309
Names & identifiers
- Preferred name
- Ethyl 2-[4-[2-oxo-5-(3-oxooct-1-enyl)pyrrolidin-1-yl]but-2-enoxy]acetate
- IUPAC
- ethyl 2-[4-[2-oxo-5-(3-oxooct-1-enyl)pyrrolidin-1-yl]but-2-enoxy]acetate
Names & synonyms
SCHEMBL5215677
Database identifiers
- PubChem CID
- 69355897
Properties
Computed structural properties
- XLogP
- 2.2
- Topological polar surface area
- 72.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 14
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 512
Related reactions
2 records
Compound notes
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