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Basic information
- Standard SMILES
CCOC(=O)C(=Cc1ccc(OCCN2COc3ccccc3C2=O)cc1)OCC- InChIKey
YUMFSIILGFRSIN-UHFFFAOYSA-N- Molecular formula
- C23H25NO6
- Average molar mass
- 411.4 g/mol
Names & identifiers
- Preferred name
- Ethyl 2-ethoxy-3-[4-[2-[4-oxo-3,4-dihydro-1,3-benzoxazin-3-yl]ethoxy]phenyl]-2-propenoate
- IUPAC
- ethyl 2-ethoxy-3-[4-[2-(4-oxo-2H-1,3-benzoxazin-3-yl)ethoxy]phenyl]prop-2-enoate
Names & synonyms
SCHEMBL7250201YUMFSIILGFRSIN-UHFFFAOYSA-Nethyl 2-ethoxy-3-[4-[2-[4-oxo-3,4-dihydro-1,3-benzoxazin-3-yl]-ethoxy]phenyl]-2-propenoateethyl 2-ethoxy-3-[4-[2-[4-oxo-3,4-dihydro-1,3-benzoxazin-3-yl]ethoxy]phenyl]-2-propenoate
Database identifiers
- PubChem CID
- 54528005
Properties
Computed structural propertiesFilling in
- XLogP
- 4.1
- Topological polar surface area
- 74.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 10
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 599
Related reactions
4 records
Compound notes
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