2'-(2-Aminoethyl)spiro[benzofuran-2(3H),4'(2'H)-isoquinoline] dihydrochloride
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Basic information
- Standard SMILES
Cl.Cl.NCCN1Cc2ccccc2C2(Cc3ccccc3O2)C1- InChIKey
PLFIULLQTIWHHN-UHFFFAOYSA-N- Molecular formula
- C18H22Cl2N2O
- Average molar mass
- 353.3 g/mol
- Monoisotopic mass
- 352.1109187
Names & identifiers
- Preferred name
- 2'-(2-Aminoethyl)spiro[benzofuran-2(3H),4'(2'H)-isoquinoline] dihydrochloride
- IUPAC
- 2-spiro[1,3-dihydroisoquinoline-4,2'-3H-1-benzofuran]-2-ylethanamine;dihydrochloride
Names & synonyms
SCHEMBL11164082PLFIULLQTIWHHN-UHFFFAOYSA-N2'-(2-Aminoethyl)spiro[benzofuran-2(3H),4'(2'H)-isoquinoline] dihydrochloride
Database identifiers
- PubChem CID
- 15917478
Properties
Computed structural propertiesFilling in
- Topological polar surface area
- 38.5 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 374
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Related reactions
2 records
Compound notes
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