Basic information
- Standard SMILES
CCN(Cc1ccccc1)C(=O)COc1ccc(CCOc2ccccc2C(=O)OC)cc1- InChIKey
VVMVHMYELCSTDZ-UHFFFAOYSA-N- Molecular formula
- C27H29NO5
- Average molar mass
- 447.5 g/mol
Names & identifiers
- Preferred name
- Methyl 2-[2-(4-{2-[benzyl(ethyl)amino)-2-oxoethoxy}phenyl)ethoxy]benzoate
- IUPAC
- methyl 2-[2-[4-[2-[benzyl(ethyl)amino]-2-oxoethoxy]phenyl]ethoxy]benzoate
Names & synonyms
Methyl 2-[2-(4-{2-[benzyl(ethyl)amino)-2-oxoethoxy}phenyl)ethoxy]benzoatemethyl 2-[2-(4-{2-[benzyl(ethyl)amino]-2-oxoethoxy}phenyl)ethoxy]benzoateSCHEMBL4963743VVMVHMYELCSTDZ-UHFFFAOYSA-N
Database identifiers
- PubChem CID
- 69259262
Properties
Computed structural properties
- XLogP
- 5.1
- Topological polar surface area
- 65.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 12
- Heavy atoms
- 33
- Formal charge
- 0
- Complexity
- 583
Related reactions
4 records
Compound notes
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