Basic information
- Standard SMILES
CCOC(=O)c1ccc(F)cc1OCC(C)CNC(=O)OC(C)(C)C- InChIKey
XSUAZUTYAFCEFY-UHFFFAOYSA-N- Molecular formula
- C18H26FNO5
- Average molar mass
- 355.4 g/mol
Names & identifiers
- Preferred name
- Ethyl-2-(3-tert-butoxycarbonylamino-2-methylpropoxy)-4-fluorobenzoate
- IUPAC
- ethyl 4-fluoro-2-[2-methyl-3-[(2-methylpropan-2-yl)oxycarbonylamino]propoxy]benzoate
Names & synonyms
SCHEMBL3164830XSUAZUTYAFCEFY-UHFFFAOYSA-Nethyl-2-(3-tert-butoxycarbonylamino-2-methylpropoxy)-4-fluorobenzoate
Database identifiers
- PubChem CID
- 68535248
Properties
Computed structural properties
- XLogP
- 3.7
- Topological polar surface area
- 73.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 10
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 438
Related reactions
2 records
Compound notes
Loading…