Basic information
- Standard SMILES
Cl.O=C1COC2(CCN(CCC3COc4ccccc4O3)CC2)CN1- InChIKey
QURFEMTYUJKZPE-UHFFFAOYSA-N- Molecular formula
- C18H25ClN2O4
- Average molar mass
- 368.9 g/mol
- Monoisotopic mass
- 368.150285
Names & identifiers
- Preferred name
- 9-[2-(1,4-Benzodioxan-2-yl)ethyl]-1-oxa-4,9-diazaspiro[5.5]undecan-3-one hydrochloride salt
- IUPAC
- 9-[2-(2,3-dihydro-1,4-benzodioxin-3-yl)ethyl]-1-oxa-4,9-diazaspiro[5.5]undecan-3-one;hydrochloride
Names & synonyms
SCHEMBL11226124QURFEMTYUJKZPE-UHFFFAOYSA-N9-[2-(1,4-benzodioxan-2-yl)ethyl]-1-oxa-4,9-diazaspiro[5.5]undecan-3-one hydrochloride salt
Database identifiers
- PubChem CID
- 20522116
Properties
Computed structural properties
- Topological polar surface area
- 60 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 3
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 450
Related reactions
1 records
Compound notes
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