Basic information
- Standard SMILES
O=C(O)C1CN(Cc2ccccc2)CCC12OCCO2- InChIKey
JSRJSIVYAZMBCO-UHFFFAOYSA-N- Molecular formula
- C15H19NO4
- Average molar mass
- 277.31 g/mol
- Monoisotopic mass
- 277.13140809
Names & identifiers
- Preferred name
- 8-Benzyl-1,4-dioxa-8-azaspiro[4.5]decane-6-carboxylic acid
- IUPAC
- 8-benzyl-1,4-dioxa-8-azaspiro[4.5]decane-6-carboxylic acid
Names & synonyms
SCHEMBL173992JSRJSIVYAZMBCO-UHFFFAOYSA-N8-benzyl-1,4-dioxa-8-azaspiro[4.5]decane-6-carboxylic acid
Database identifiers
- PubChem CID
- 66613634
Properties
Computed structural properties
- XLogP
- -1.4
- Topological polar surface area
- 59 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 3
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 348
Related reactions
1 records
Compound notes
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