Basic information
- Standard SMILES
CCCCC12CCC(=O)C(c3ccco3)=C1c1cc(F)c(NC(C)=O)c(Cl)c1C2- InChIKey
JUUCLDFGNNYINW-UHFFFAOYSA-N- Molecular formula
- C23H23ClFNO3
- Average molar mass
- 415.9 g/mol
Names & identifiers
- Preferred name
- 7-(acetylamino)-9a-butyl-8-chloro-6-fluoro4-(2-furyl)-1,2,9,9a-tetrahydro-3H-fluoren-3-one
- IUPAC
- N-[8a-butyl-1-chloro-3-fluoro-5-(furan-2-yl)-6-oxo-8,9-dihydro-7H-fluoren-2-yl]acetamide
Names & synonyms
SCHEMBL5343318JUUCLDFGNNYINW-UHFFFAOYSA-N7-(acetylamino)-9a-butyl-8-chloro-6-fluoro4-(2-furyl)-1,2,9,9a-tetrahydro-3H-fluoren-3-one
Database identifiers
- PubChem CID
- 21072011
Properties
Computed structural properties
- XLogP
- 4.7
- Topological polar surface area
- 59.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 710
Related reactions
2 records
Compound notes
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