Basic information
- Standard SMILES
O=C1c2cccc3cccc(c23)C(=O)N1CCN1CC2CCC(CC2)C1- InChIKey
MDJFZGQGVCZKMB-UHFFFAOYSA-N- Molecular formula
- C22H24N2O2
- Average molar mass
- 348.4 g/mol
Names & identifiers
- Preferred name
- 2-[2-(3-Azabicyclo[3.2.2]nonan-3-yl)ethyl]-1H-benz[de]-isoquinoline-1,3(2H)-dione
- IUPAC
- 2-[2-(3-azabicyclo[3.2.2]nonan-3-yl)ethyl]benzo[de]isoquinoline-1,3-dione
Names & synonyms
SCHEMBL11689761MDJFZGQGVCZKMB-UHFFFAOYSA-N2-[2-(3-Azabicyclo[3.2.2]nonan-3-yl)ethyl]-1H-benz[de]-isoquinoline-1,3(2H)-dione
Database identifiers
- PubChem CID
- 21393691
Properties
Computed structural properties
- XLogP
- 3.7
- Topological polar surface area
- 40.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 524
Related reactions
1 records
Linked notes
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