Homodihydropapaverine hydrochloride
Basic information
- CAS
81182-04-9- Standard SMILES
COc1ccc(CCC2=[NH+]CCc3cc(OC)c(OC)cc32)cc1OC.[Cl-]- InChIKey
WUTCTQAGOQDBIW-UHFFFAOYSA-N- Molecular formula
- C21H26ClNO4
- Average molar mass
- 391.9 g/mol
- Monoisotopic mass
- 391.155036
Names & identifiers
- Preferred name
- Homodihydropapaverine hydrochloride
- IUPAC
- 1-[2-(3,4-dimethoxyphenyl)ethyl]-6,7-dimethoxy-3,4-dihydroisoquinolin-2-ium chloride
Names & synonyms
Homodihydropapaverine hydrochlorideHomodihydropapaverine HCl81182-04-93,4-Dihydro-6,7-dimethoxy-1-(3,4-dimethoxyphenethyl)isoquinoline hydrochlorideIsoquinoline, 3,4-dihydro-6,7-dimethoxy-1-(3,4-dimethoxyphenethyl)-, hydrochlorideRefChem:347836
Database identifiers
- CAS
81182-04-9- PubChem CID
- 54694
Properties
Computed structural properties
- Topological polar surface area
- 50.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 7
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 469
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…