Basic information
- Standard SMILES
CCOC(C)O[C@@H]1C[C@H](C(=O)OC)[C@@H](C(=O)OCc2ccccc2)N(Cc2ccccc2)C1- InChIKey
NFRQPDOZEOPPSN-BSAJRSAISA-N- Molecular formula
- C26H33NO6
- Average molar mass
- 455.5 g/mol
Names & identifiers
- Preferred name
- 2-benzyl 3-methyl (2S,3S,5R)-1-benzyl-5-(1-ethoxyethoxy)piperidine-2,3-dicarboxylate
- IUPAC
- 2-O-benzyl 3-O-methyl (2S,3S,5R)-1-benzyl-5-(1-ethoxyethoxy)piperidine-2,3-dicarboxylate
Names & synonyms
NFRQPDOZEOPPSN-BSAJRSAISA-N2-benzyl 3-methyl (2S,3S,5R)-1-benzyl-5-(1-ethoxyethoxy)piperidine-2,3-dicarboxylate2-benzyl 3-methyl(2S,3S,5R)-1-benzyl-5-(1-ethoxyethoxy)piperidine-2,3-dicarboxylate
Database identifiers
- PubChem CID
- 131731925
Properties
Computed structural properties
- XLogP
- 3.9
- Topological polar surface area
- 74.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 12
- Heavy atoms
- 33
- Formal charge
- 0
- Complexity
- 602
Related reactions
4 records
Compound notes
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