Basic information
- CAS
56220-82-7- Standard SMILES
CNCCCCC1(C)OCCn2c1c(C)c1ccccc12.Cl- InChIKey
WTMRWJXFSPEILP-UHFFFAOYSA-N- Molecular formula
- C18H27ClN2O
- Average molar mass
- 322.9 g/mol
- Monoisotopic mass
- 322.1811912
Names & identifiers
- Preferred name
- 1H-(1,4)Oxazino(4,3-a)indole, 3,4-dihydro-1,10-dimethyl-1-((4-methylamino)butyl)-, hydrochloride
- IUPAC
- 4-(1,10-dimethyl-3,4-dihydro-[1,4]oxazino[4,3-a]indol-1-yl)-N-methylbutan-1-amine;hydrochloride
Names & synonyms
1H-(1,4)Oxazino(4,3-a)indole, 3,4-dihydro-1,10-dimethyl-1-((4-methylamino)butyl)-, hydrochloride56220-82-7RefChem:236887DTXSID309716334-(1,10-Dimethyl-3,4-dihydro-1H-[1,4]oxazino[4,3-a]indol-1-yl)-N-methylbutan-1-amine--hydrogen chloride (1/1)
Database identifiers
- CAS
56220-82-7- PubChem CID
- 3043836
- DTXSID
DTXSID30971633
Properties
Computed structural properties
- Topological polar surface area
- 26.2 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 5
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 348
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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