N-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-4-nitrobenzamide
Basic information
- CAS
305856-19-3- Standard SMILES
O=C(NN1C(=O)c2ccccc2C1=O)c1ccc([N+](=O)[O-])cc1- InChIKey
BRNUNGQDJMNVOJ-UHFFFAOYSA-N- Molecular formula
- C15H9N3O5
- Average molar mass
- 311.25 g/mol
- Monoisotopic mass
- 311.0542204
Names & identifiers
- Preferred name
- N-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-4-nitrobenzamide
- IUPAC
- N-(1,3-dioxoisoindol-2-yl)-4-nitrobenzamide
Names & synonyms
305856-19-3N-(1,3-Dioxoisoindolin-2-yl)-4-nitrobenzamideN-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-4-nitrobenzamideSTK156012N-(1,3-dioxoisoindol-2-yl)-4-nitrobenzamideDTXSID30356845AKOS000629886
Database identifiers
- CAS
305856-19-3- PubChem CID
- 835296
- DTXSID
DTXSID30356845
Properties
Computed structural properties
- XLogP
- 1.9
- Topological polar surface area
- 112 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 1
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 512
Suppliers
Loading…
Open inquiries
Loading…
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…