Basic information
- Standard SMILES
O=C(c1ccncc1)[N+]1([O-])CCC(=C2c3ccccc3CCn3ccnc32)CC1- InChIKey
AVDQGRBHBHJOND-UHFFFAOYSA-N- Molecular formula
- C23H22N4O2
- Average molar mass
- 386.4 g/mol
Names & identifiers
- Preferred name
- 4-(5,6-dihydro-11H-imidazo[2,1-b][3]benzazepin-11-ylidene)-1-(4-pyridinylcarbonyl)-piperidine N1-oxide
- IUPAC
- [4-(5,6-dihydroimidazo[2,1-b][3]benzazepin-11-ylidene)-1-oxidopiperidin-1-ium-1-yl]-pyridin-4-ylmethanone
Names & synonyms
AVDQGRBHBHJOND-UHFFFAOYSA-N4-(5,6-dihydro-11H-imidazo[2,1-b][3]benzazepin-11-ylidene)-1-(4-pyridinylcarbonyl)-piperidine N1 -oxide
Database identifiers
- PubChem CID
- 86748484
Properties
Computed structural properties
- XLogP
- 1.7
- Topological polar surface area
- 65.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 1
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 647
Related reactions
3 records
Compound notes
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