2-(Morpholin-4-yl)ethyl 3-methyl-4-oxo-2-phenyl-4H-1-benzopyran-8-carboxylate--hydrogen chloride (1/1)
Basic information
- CAS
3468-02-8- Standard SMILES
Cc1c(-c2ccccc2)oc2c(C(=O)OCC[NH+]3CCOCC3)cccc2c1=O.[Cl-]- InChIKey
OQENDBITKXIGSD-UHFFFAOYSA-N- Molecular formula
- C23H24ClNO5
- Average molar mass
- 429.9 g/mol
- Monoisotopic mass
- 429.1343006
Names & identifiers
- Preferred name
- 2-(Morpholin-4-yl)ethyl 3-methyl-4-oxo-2-phenyl-4H-1-benzopyran-8-carboxylate--hydrogen chloride (1/1)
- IUPAC
- 2-morpholin-4-ium-4-ylethyl 3-methyl-4-oxo-2-phenylchromene-8-carboxylate chloride
Names & synonyms
3468-02-8DTXSID109561602-(Morpholin-4-yl)ethyl 3-methyl-4-oxo-2-phenyl-4H-1-benzopyran-8-carboxylate--hydrogen chloride (1/1)RefChem:1061928DTXCID101384133Morpholinoethyl 3-methylflavone-8-carboxylate hydrochlorideREC 7-00374H-1-Benzopyran-8-carboxylic acid, 3-methyl-4-oxo-2-phenyl-, 2-morpholinoethyl ester, monohydrochloride
Database identifiers
- CAS
3468-02-8- PubChem CID
- 18966
Properties
Computed structural properties
- Topological polar surface area
- 66.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 6
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 633
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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