Basic information
- CAS
56220-93-0- Standard SMILES
Br.Cc1c2n(c3ccccc13)CCOC2(C)CCCN1CCCCC1- InChIKey
BJURGXYAUUSSCI-UHFFFAOYSA-N- Molecular formula
- C21H31BrN2O
- Average molar mass
- 407.4 g/mol
- Monoisotopic mass
- 406.16198
Names & identifiers
- Preferred name
- 1H-(1,4)Oxazino(4,3-a)indole, 3,4-dihydro-1,10-dimethyl-1-((3-piperidino)propyl)-, hydrobromide
- IUPAC
- 1,10-dimethyl-1-(3-piperidin-1-ylpropyl)-3,4-dihydro-[1,4]oxazino[4,3-a]indole;hydrobromide
Names & synonyms
1H-(1,4)Oxazino(4,3-a)indole, 3,4-dihydro-1,10-dimethyl-1-((3-piperidino)propyl)-, hydrobromide56220-93-0RefChem:236886DTXSID609716411,10-Dimethyl-1-[3-(piperidin-1-yl)propyl]-3,4-dihydro-1H-[1,4]oxazino[4,3-a]indole--hydrogen bromide (1/1)
Database identifiers
- CAS
56220-93-0- PubChem CID
- 3043854
- DTXSID
DTXSID60971641
Properties
Computed structural properties
- Topological polar surface area
- 17.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 422
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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