Basic information
- Standard SMILES
COc1ccc2c3c1OC1C(=O)CC=C4C(C2)N(C)CCC431- InChIKey
LJVKMVSYTWPNGA-UHFFFAOYSA-N- Molecular formula
- C18H19NO3
- Average molar mass
- 297.3 g/mol
Overview
See also: Neopinone (annotation moved to).
Names & identifiers
- Preferred name
- 3-Methoxy-17-methyl-8,14-didehydro-4,5-epoxymorphinan-6-one
- IUPAC
- 9-methoxy-3-methyl-1,2,4,6,7a,13-hexahydro-4,12-methanobenzofuro[3,2-e]isoquinolin-7-one
Names & synonyms
DS-0166553-methoxy-17-methyl-8,14-didehydro-4,5-epoxymorphinan-6-one
Database identifiers
- PubChem CID
- 5209499
Properties
Computed structural properties
- XLogP
- 1.7
- Topological polar surface area
- 38.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 1
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 559
Related reactions
1 records
Compound notes
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