Basic information
- CAS
3380-83-4- Standard SMILES
Brc1ccc(C2NCCc3c2[nH]c2ccccc32)cc1.Cl- InChIKey
SOQQCTUZLMIQCU-UHFFFAOYSA-N- Molecular formula
- C17H16BrClN2
- Average molar mass
- 363.7 g/mol
- Monoisotopic mass
- 362.01854
Names & identifiers
- Preferred name
- 9H-Pyrido(3,4-b)indole, 1,2,3,4-tetrahydro-1-(p-bromophenyl)-, hydrochloride
- IUPAC
- 1-(4-bromophenyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole;hydrochloride
Names & synonyms
9H-Pyrido(3,4-b)indole, 1,2,3,4-tetrahydro-1-(p-bromophenyl)-, hydrochloride3380-83-41-(p-Bromophenyl)tetrahydronorharman hydrochlorideRefChem:3136381-(4-bromophenyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole;hydrochlorideDTXSID40955388AKOS008017605Z489682201-(4-bromophenyl)-2,3,4,9-tetrahydro-1H-beta-carboline hydrochloride1-(4-Bromophenyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole--hydrogen chloride (1/1)
Database identifiers
- CAS
3380-83-4- PubChem CID
- 201185
- DTXSID
DTXSID40955388
Properties
Computed structural properties
- Topological polar surface area
- 27.8 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 1
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 340
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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