1H-Benz(de)isoquinoline-1,3(2H)-dione, 2-(2-(dimethylamino)ethyl)-6-nitro-
Basic information
- CAS
88145-14-6- Standard SMILES
CN(C)CCN1C(=O)c2cccc3c([N+](=O)[O-])ccc(c23)C1=O- InChIKey
VPYVRSPRQFQZFM-UHFFFAOYSA-N- Molecular formula
- C16H15N3O4
- Average molar mass
- 313.31 g/mol
- Monoisotopic mass
- 313.10625597
Names & identifiers
- Preferred name
- 1H-Benz(de)isoquinoline-1,3(2H)-dione, 2-(2-(dimethylamino)ethyl)-6-nitro-
- IUPAC
- 2-[2-(dimethylamino)ethyl]-6-nitrobenzo[de]isoquinoline-1,3-dione
Names & synonyms
88145-14-61H-Benz(de)isoquinoline-1,3(2H)-dione, 2-(2-(dimethylamino)ethyl)-6-nitro-2-(2-(DIMETHYLAMINO)ETHYL)-6-NITRO-1H-BENZO[DE]ISOQUINOLINE-1,3(2H)-DIONE2-[2-(dimethylamino)ethyl]-6-nitro-1H-benzo[de]isoquinoline-1,3(2H)-dioneCHEMBL43503SCHEMBL3759222DTXSID50236852F70082N-(2-Dimethylamino-ethyl)-4-nitro-1,8-naphthalimide
Database identifiers
- CAS
88145-14-6- PubChem CID
- 159209
- DTXSID
DTXSID50236852- ChEMBL
CHEMBL43503
Properties
Computed structural properties
- XLogP
- 2
- Topological polar surface area
- 86.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 3
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 516
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…