Basic information
- CAS
63080-44-4- Standard SMILES
COc1cc2c3c(c1OC)C1(CCCC1)CCC3NCC2.Cl- InChIKey
LORISXHFRNHBOC-UHFFFAOYSA-N- Molecular formula
- C18H26ClNO2
- Average molar mass
- 323.9 g/mol
- Monoisotopic mass
- 323.1652068
Names & identifiers
- Preferred name
- Spiro(7H-benzo(de)quinoline-7,1'-cyclopentane), 1,2,3,8,9,9a-hexahydro-5,6-dimethoxy-, hydrochloride
- IUPAC
- 5,6-dimethoxyspiro[1,2,3,8,9,9a-hexahydrobenzo[de]quinoline-7,1'-cyclopentane];hydrochloride
Names & synonyms
5,6-Dimethoxy-2,3,7,8,9,9a-hexahydrospiro(1H-benzo(de)chinolin-7,1'-cyclopentan)-hydrochloride63080-44-4Spiro(7H-benzo(de)quinoline-7,1'-cyclopentane), 1,2,3,8,9,9a-hexahydro-5,6-dimethoxy-, hydrochlorideRefChem:380934DTXSID409790295,6-Dimethoxy-1,2,3,8,9,9a-hexahydrospiro[benzo[de]quinoline-7,1'-cyclopentane]--hydrogen chloride (1/1)
Database identifiers
- CAS
63080-44-4- PubChem CID
- 3047232
- DTXSID
DTXSID40979029
Properties
Computed structural properties
- Topological polar surface area
- 30.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 379
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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