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Basic information
- Standard SMILES
C/C=C/COc1ccc(C(=O)NC(Cc2ccc(OC(F)(F)F)cc2)C(=O)OC(C)(C)C)cc1- InChIKey
RGFUJKUBEPYLDY-AATRIKPKSA-N- Molecular formula
- C25H28F3NO5
- Average molar mass
- 479.5 g/mol
- Monoisotopic mass
- 479.19195748
Names & identifiers
- Preferred name
- Tert-butyl 2-({4-[(2e)-but-2-en-1-yloxy]benzoyl}amino)-3-[4-(trifluoromethoxy)phenyl]propanoate
- IUPAC
- tert-butyl 2-[[4-[(E)-but-2-enoxy]benzoyl]amino]-3-[4-(trifluoromethoxy)phenyl]propanoate
Names & synonyms
tert-butyl 2-({4-[(2e)-but-2-en-1-yloxy]benzoyl}amino)-3-[4-(trifluoromethoxy)phenyl]propanoateSCHEMBL4372968
Database identifiers
- PubChem CID
- 69020161
Properties
Computed structural propertiesFilling in
- XLogP
- 6.1
- Topological polar surface area
- 73.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 11
- Heavy atoms
- 34
- Formal charge
- 0
- Complexity
- 673
Related reactions
1 records
Compound notes
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