Basic information
- CAS
30836-93-2- Standard SMILES
COc1cc2cc[n+]3c4ccc([N+](=O)[O-])cc4ccc3c2cc1OC.[Cl-]- InChIKey
GUSRGVFRDIWAEY-UHFFFAOYSA-M- Molecular formula
- C19H15ClN2O4
- Average molar mass
- 370.8 g/mol
- Monoisotopic mass
- 370.0720347
Names & identifiers
- Preferred name
- 9,10-Dimethoxy-2-nitroisoquinolino[2,1-a]quinolin-5-ium chloride
- IUPAC
- 9,10-dimethoxy-2-nitroisoquinolino[2,1-a]quinolin-5-ium chloride
Names & synonyms
30836-93-2CHEMBL609717DTXSID106110609,10-Dimethoxy-2-nitroisoquinolino[2,1-a]quinolin-5-ium chlorideNSC340011NSC-340011Dibenzo[a, 9,10-dimethoxy-2-nitro-, chloride
Database identifiers
- CAS
30836-93-2- PubChem CID
- 21144827
- DTXSID
DTXSID10611060- ChEMBL
CHEMBL609717
Properties
Computed structural properties
- Topological polar surface area
- 68.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 2
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 496
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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