Basic information
- Standard SMILES
CCOC(=O)C(=O)CCCCCCC1CCN(C(=O)OCc2ccccc2)CC1- InChIKey
DKLHGNMBIYMZND-UHFFFAOYSA-N- Molecular formula
- C23H33NO5
- Average molar mass
- 403.5 g/mol
- Monoisotopic mass
- 403.23587315
Names & identifiers
- Preferred name
- Ethyl 8-(1-benzyloxycarbonyl-4-piperidyl)-2-oxooctanoate
- IUPAC
- benzyl 4-(8-ethoxy-7,8-dioxooctyl)piperidine-1-carboxylate
Names & synonyms
SCHEMBL7282088DKLHGNMBIYMZND-UHFFFAOYSA-Nethyl 8-(1-benzyloxycarbonyl-4-piperidyl)-2-oxooctanoate
Database identifiers
- PubChem CID
- 20143649
Properties
Computed structural properties
- XLogP
- 5
- Topological polar surface area
- 72.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 13
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 507
Related reactions
3 records
Compound notes
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