Fluorocarpamine-N-oxide
Basic information
- CAS
88746-40-1- Standard SMILES
C/C=C1\C[N+]2([O-])CCC34C(=O)c5ccccc5N3C(C(=O)OC)C1CC42- InChIKey
IARXKEXPNHDQQC-KGVSQERTSA-N- Molecular formula
- C20H22N2O4
- Average molar mass
- 354.4 g/mol
- Monoisotopic mass
- 354.15795719
Names & identifiers
- Preferred name
- Fluorocarpamine-N-oxide
- IUPAC
- methyl (12Z)-12-ethylidene-14-oxido-2-oxo-9-aza-14-azoniapentacyclo[9.5.2.01,9.03,8.014,17]octadeca-3,5,7-triene-10-carboxylate
Names & synonyms
Fluorocarpamine-N-oxide88746-40-1
Database identifiers
- CAS
88746-40-1- PubChem CID
- 6442964
Properties
Computed structural properties
- XLogP
- 1.6
- Topological polar surface area
- 64.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 2
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 706
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…