Basic information
- Standard SMILES
CCCCCC(=O)/C=C/C1CCCC(=O)N1CCCCCCC(=O)OC- InChIKey
ZNGQEGNFYKFLPV-FOCLMDBBSA-N- Molecular formula
- C21H35NO4
- Average molar mass
- 365.5 g/mol
- Monoisotopic mass
- 365.2566086
Names & identifiers
- Preferred name
- 7-[2-Oxo-6-((E)-3-oxo-oct-1-enyl)-piperidin-1-yl]-heptanoic acid methyl ester
- IUPAC
- methyl 7-[2-oxo-6-[(E)-3-oxooct-1-enyl]piperidin-1-yl]heptanoate
Names & synonyms
SCHEMBL4376510ZNGQEGNFYKFLPV-FOCLMDBBSA-N7-[2-Oxo-6-((E)-3-oxo-oct-1-enyl)-piperidin-1-yl]-heptanoic acid methyl ester
Database identifiers
- PubChem CID
- 10384243
Properties
Computed structural properties
- XLogP
- 3.5
- Topological polar surface area
- 63.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 14
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 473
Related reactions
6 records
Compound notes
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