Basic information
- Standard SMILES
CCOC(=O)C(Cc1ccc(OCCc2ccc(NC(=O)OC)cc2)cc1)OCC- InChIKey
FDXRVDBNUDBZGQ-UHFFFAOYSA-N- Molecular formula
- C23H29NO6
- Average molar mass
- 415.5 g/mol
- Monoisotopic mass
- 415.19948764
Names & identifiers
- Preferred name
- Ethyl 2-ethoxy-3-[4-[2-[4-(methoxycarbonylamino)phenyl]ethoxy]phenyl]propanoate
- IUPAC
- ethyl 2-ethoxy-3-[4-[2-[4-(methoxycarbonylamino)phenyl]ethoxy]phenyl]propanoate
Names & synonyms
SCHEMBL5994334
Database identifiers
- PubChem CID
- 69629331
Properties
Computed structural properties
- XLogP
- 4.2
- Topological polar surface area
- 83.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 13
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 498
Related reactions
2 records
Compound notes
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