Basic information
- CAS
68061-42-7- Standard SMILES
COc1cc(NC(=O)CN2CCOCC2)cc(OC)c1OC.O=P(O)(O)O- InChIKey
WVKMLNLXMFZQRD-UHFFFAOYSA-N- Molecular formula
- C15H25N2O9P
- Average molar mass
- 408.34 g/mol
- Monoisotopic mass
- 408.12976738
Names & identifiers
- Preferred name
- 4-Morpholineacetamide, N-(3,4,5-trimethoxyphenyl)-, phosphate
- IUPAC
- 2-morpholin-4-yl-N-(3,4,5-trimethoxyphenyl)acetamide;phosphoric acid
Names & synonyms
4-Morpholineacetamide, N-(3,4,5-trimethoxyphenyl)-, phosphateN-(3,4,5-Trimethoxyphenyl)-4-morpholineacetamide phosphate68061-42-7DTXSID20218281RefChem:294772DTXCID40140772Phosphoric acid--2-(morpholin-4-yl)-N-(3,4,5-trimethoxyphenyl)acetamide (1/1)
Database identifiers
- CAS
68061-42-7- PubChem CID
- 3051925
- DTXSID
DTXSID20218281
Properties
Computed structural properties
- Topological polar surface area
- 147 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 10
- Rotatable bonds
- 6
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 385
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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