Basic information
- CAS
55218-91-2- Standard SMILES
COc1ccoc2c(OCC(O)C[NH2+]C(C)C)c3oc(C)cc3c(=O)c1-2.[Cl-]- InChIKey
OSLFBSQMMORMEI-UHFFFAOYSA-N- Molecular formula
- C19H24ClNO6
- Average molar mass
- 397.8 g/mol
- Monoisotopic mass
- 397.1292152
Names & identifiers
- Preferred name
- 5H-Furo(3,2-g)(1)benzopyran-5-one, 9-(2-hydroxy-3-isopropylaminopropoxy)-4-methoxy-7-methyl-, hydrochloride
- IUPAC
- [2-hydroxy-3-(5-methoxy-2-methyl-4-oxofuro[3,2-g]chromen-9-yl)oxypropyl]-propan-2-ylazanium chloride
Names & synonyms
55218-91-25H-Furo(3,2-g)(1)benzopyran-5-one, 9-(2-hydroxy-3-isopropylaminopropoxy)-4-methoxy-7-methyl-, hydrochlorideFuro(3,2-g)chromone, 9-(2-hydroxy-3-isopropylaminopropoxy)-4-methoxy-7-methyl-,hydrochlorideRefChem:305648
Database identifiers
- CAS
55218-91-2- PubChem CID
- 41366
Properties
Computed structural properties
- Topological polar surface area
- 94.7 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 7
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 650
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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