Basic information
- Standard SMILES
CCN1C(=O)CC(C)(C)c2cc(C)c(-c3c(OC)ccc(C=O)c3F)cc21- InChIKey
CYKREIUNECUPJV-UHFFFAOYSA-N- Molecular formula
- C22H24FNO3
- Average molar mass
- 369.4 g/mol
Names & identifiers
- Preferred name
- 2-Fluoro-4-methoxy-3-(1-ethyl-4,4,6-trimethyl-2-oxo-1,2,3,4-tetrahydro-quinolin-7-yl)-benzaldehyde
- IUPAC
- 3-(1-ethyl-4,4,6-trimethyl-2-oxo-3H-quinolin-7-yl)-2-fluoro-4-methoxybenzaldehyde
Names & synonyms
SCHEMBL5758555CYKREIUNECUPJV-UHFFFAOYSA-N2-Fluoro-4-methoxy-3-(1-ethyl-4,4,6-trimethyl-2-oxo-1,2,3,4-tetrahydro-quinolin-7-yl)-benzaldehyde
Database identifiers
- PubChem CID
- 21966432
Properties
Computed structural properties
- XLogP
- 4
- Topological polar surface area
- 46.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 566
Related reactions
2 records
Compound notes
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