Basic information
- CAS
101832-29-5- Standard SMILES
CCN(CC)CC[NH+]1CCc2cc(OC)c(OC)c3c2[C@@H]1Cc1ccc(O)c(OC)c1-3.[Cl-]- InChIKey
SRKXKYSOEFEXHL-FERBBOLQSA-N- Molecular formula
- C25H35ClN2O4
- Average molar mass
- 463 g/mol
- Monoisotopic mass
- 462.2285353
Names & identifiers
- Preferred name
- 6a-alpha-Noraporphin-9-ol, 6-(2-(diethylamino)ethyl)-1,2,10-trimethoxy-, monohydrochloride
- IUPAC
- (6aS)-6-[2-(diethylamino)ethyl]-1,2,11-trimethoxy-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinolin-6-ium-10-ol chloride
Names & synonyms
6a-alpha-Noraporphin-9-ol, 6-(2-(diethylamino)ethyl)-1,2,10-trimethoxy-, monohydrochloride6-(2-(Diethylamino)ethyl)-1,2,10-trimethoxy-6a-alpha-noraporphin-9-ol monohydrochloride101832-29-5RefChem:309449
Database identifiers
- CAS
101832-29-5- PubChem CID
- 58989
Properties
Computed structural properties
- Topological polar surface area
- 55.6 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 8
- Heavy atoms
- 32
- Formal charge
- 0
- Complexity
- 574
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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