Completing data — refresh the page later to see the latest
Basic information
- Standard SMILES
COC(=O)c1ccc(CCC(CCc2ccc(C(=O)OC)cc2)C(=O)O)cc1- InChIKey
FTWKEBOMDVNRJL-UHFFFAOYSA-N- Molecular formula
- C22H24O6
- Average molar mass
- 384.4 g/mol
Names & identifiers
- Preferred name
- 4-[4-(Methoxycarbonyl)phenyl]-2-{2-[4-(methoxycarbonyl)phenyl]ethyl}butanoic acid
- IUPAC
- 4-(4-methoxycarbonylphenyl)-2-[2-(4-methoxycarbonylphenyl)ethyl]butanoic acid
Names & synonyms
SCHEMBL2160659FTWKEBOMDVNRJL-UHFFFAOYSA-N4-[4-(methoxycarbonyl)phenyl]-2-{2-[4-(methoxy-carbonyl)phenyl]ethyl}butanoic acid4-[4-(methoxycarbonyl)phenyl]-2-{2-[4-(methoxycarbonyl)-phenyl]ethyl}butanoic acid4-[4-(Methoxycarbonyl)phenyl]-2-{2-[4-(methoxycarbonyl)phenyl]ethyl}butanoic acid
Database identifiers
- PubChem CID
- 59397495
Properties
Computed structural propertiesFilling in
- XLogP
- 4.1
- Topological polar surface area
- 89.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 11
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 475
Related reactions
5 records
Compound notes
Loading…