Quinine resorcine hydrochloride
Basic information
- CAS
115160-11-7- Standard SMILES
C=CC1CN2CCC1CC2C(O)c1ccnc2ccc(OC)cc12.Cl.Oc1cccc(O)c1- InChIKey
FKPRJAFCZNCGJZ-UHFFFAOYSA-N- Molecular formula
- C26H31ClN2O4
- Average molar mass
- 471 g/mol
- Monoisotopic mass
- 470.1972352
Names & identifiers
- Preferred name
- Quinine resorcine hydrochloride
- IUPAC
- benzene-1,3-diol;(5-ethenyl-1-azabicyclo[2.2.2]octan-2-yl)-(6-methoxyquinolin-4-yl)methanol;hydrochloride
Names & synonyms
115160-11-7Quinine resorcine hydrochlorideDTXSID70921637Benzene-1,3-diol--6'-methoxycinchonan-9-ol--hydrogen chloride (1/1/1)
Database identifiers
- CAS
115160-11-7- PubChem CID
- 189274
- DTXSID
DTXSID70921637
Properties
Computed structural properties
- Topological polar surface area
- 86.1 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 4
- Heavy atoms
- 33
- Formal charge
- 0
- Complexity
- 522
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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