Basic information
- Standard SMILES
CCCC(NC(C)C(=O)N1C2=C(CCCC2)CC1C(=O)OCc1ccccc1)C(=O)OCC- InChIKey
UCASZFYRYYFGHP-UHFFFAOYSA-N- Molecular formula
- C26H36N2O5
- Average molar mass
- 456.6 g/mol
- Monoisotopic mass
- 456.26242225
Names & identifiers
- IUPAC
- benzyl 1-[2-[(1-ethoxy-1-oxopentan-2-yl)amino]propanoyl]-2,3,4,5,6,7-hexahydroindole-2-carboxylate
Database identifiers
- PubChem CID
- 72803213
Properties
Computed structural properties
- XLogP
- 4
- Topological polar surface area
- 84.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 12
- Heavy atoms
- 33
- Formal charge
- 0
- Complexity
- 728
Related reactions
1 records
Compound notes
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