Basic information
- CAS
63732-79-6- Standard SMILES
Br.CCC(=CCN1CC[C@]23CCCC[C@H]2[C@H]1Cc1ccc(O)cc13)CC- InChIKey
YRKLNGSPBGWYKJ-TYMHPWAKSA-N- Molecular formula
- C23H34BrNO
- Average molar mass
- 420.4 g/mol
- Monoisotopic mass
- 419.18238
Names & identifiers
- Preferred name
- 17-(3-Ethylpent-2-en-1-yl)morphinan-3-ol--hydrogen bromide (1/1)
- IUPAC
- (1R,9R,10R)-17-(3-ethylpent-2-enyl)-17-azatetracyclo[7.5.3.01,10.02,7]heptadeca-2(7),3,5-trien-4-ol;hydrobromide
Names & synonyms
63732-79-6DTXSID6098023317-(3-Ethylpent-2-en-1-yl)morphinan-3-ol--hydrogen bromide (1/1)RefChem:1057592DTXCID501407511(-)-17-(3-Ethyl-2-pentenyl)morphinan-3-ol hydrobromideMorphinan-3-ol, 17-(3-ethyl-2-pentenyl)-, hydrobromide, (-)-
Database identifiers
- CAS
63732-79-6- PubChem CID
- 5486102
- DTXSID
DTXSID60980233
Properties
Computed structural properties
- Topological polar surface area
- 23.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 494
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…