Basic information
- Standard SMILES
COC(=O)C1COCC(C)N(Cc2ccccc2)C1=O- InChIKey
QOLXMDISLGVFEV-UHFFFAOYSA-N- Molecular formula
- C15H19NO4
- Average molar mass
- 277.31 g/mol
Names & identifiers
- Preferred name
- Methyl 4-benzyl-3-methyl-5-oxo-1,4-oxazepane-6-carboxylate
- IUPAC
- methyl 4-benzyl-3-methyl-5-oxo-1,4-oxazepane-6-carboxylate
Names & synonyms
SCHEMBL2340243QOLXMDISLGVFEV-UHFFFAOYSA-Nmethyl 4-benzyl-3-methyl-5-oxo-1,4-oxazepane-6-carboxylate
Database identifiers
- PubChem CID
- 67369976
Properties
Computed structural properties
- XLogP
- 1.3
- Topological polar surface area
- 55.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 352
Related reactions
2 records
Compound notes
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