4-Chloro-2-(((4-(dimethylamino)phenyl)imino)methyl)-6-methoxy-1-methylquinolin-1-ium chloride
Basic information
- CAS
6625-79-2- Standard SMILES
COc1ccc2c(c1)c(Cl)cc(C=Nc1ccc(N(C)C)cc1)[n+]2C.[Cl-]- InChIKey
KGVAVGYZRPIHBW-UHFFFAOYSA-M- Molecular formula
- C20H21Cl2N3O
- Average molar mass
- 390.3 g/mol
- Monoisotopic mass
- 389.1061677
Names & identifiers
- Preferred name
- 4-Chloro-2-(((4-(dimethylamino)phenyl)imino)methyl)-6-methoxy-1-methylquinolin-1-ium chloride
- IUPAC
- 4-[(4-chloro-6-methoxy-1-methylquinolin-1-ium-2-yl)methylideneamino]-N,N-dimethylaniline chloride
Names & synonyms
4-chloro-2-(((4-(dimethylamino)phenyl)imino)methyl)-6-methoxy-1-methylquinolin-1-ium chlorideSCHEMBL6332723SCHEMBL6332727NSC58524NSC-58524
Database identifiers
- CAS
6625-79-2- PubChem CID
- 22263302
Properties
Computed structural properties
- Topological polar surface area
- 28.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 450
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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