Basic information
- CAS
65876-18-8- Standard SMILES
COc1cc(OCC(=O)NCC[NH+]2CCOCC2)cc(OC)c1OC.[Cl-]- InChIKey
IMERTOJJAPUCJF-UHFFFAOYSA-N- Molecular formula
- C17H27ClN2O6
- Average molar mass
- 390.9 g/mol
- Monoisotopic mass
- 390.1557643
Names & identifiers
- Preferred name
- Acetamide, N-(2-(4-morpholinyl)ethyl)-2-(3,4,5-trimethoxyphenoxy)-, hydrochloride, hydrate (2:2:1)
- IUPAC
- N-(2-morpholin-4-ium-4-ylethyl)-2-(3,4,5-trimethoxyphenoxy)acetamide chloride
Names & synonyms
VUFB-898865876-18-8N-(2-Morpholinoethyl)-3,4,5-trimethoxyphenoxyacetamide hydrochloride hemihydrateAcetamide, N-(2-(4-morpholinyl)ethyl)-2-(3,4,5-trimethoxyphenoxy)-, hydrochloride, hydrate (2:2:1)RefChem:314999
Database identifiers
- CAS
65876-18-8- PubChem CID
- 47729
Properties
Computed structural properties
- Topological polar surface area
- 79.7 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 9
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 377
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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