Basic information
- Standard SMILES
CC(C)(C)C(=O)Oc1ccc2nc3cc(CCCO)c(=O)cc-3oc2c1- InChIKey
XOFUIALULKZILE-UHFFFAOYSA-N- Molecular formula
- C20H21NO5
- Average molar mass
- 355.4 g/mol
Names & identifiers
- Preferred name
- 8-(3-Hydroxypropyl)-7-oxophenoxazin-3-yl 2,2-dimethylpropanoate
- IUPAC
- [8-(3-hydroxypropyl)-7-oxophenoxazin-3-yl] 2,2-dimethylpropanoate
Names & synonyms
SCHEMBL532222XOFUIALULKZILE-UHFFFAOYSA-N8-(3-hydroxypropyl)-7-oxophenoxazin-3-yl 2,2-dimethylpropanoate
Database identifiers
- PubChem CID
- 22672525
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 85.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 6
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 683
Related reactions
7 records
Compound notes
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