Basic information
- Standard SMILES
CCN(CC)C(=O)C=C1C=C(C(C)(C)C)C(=O)C(C(C)(C)C)=C1- InChIKey
XLUYBJZPUGOPSS-UHFFFAOYSA-N- Molecular formula
- C20H31NO2
- Average molar mass
- 317.5 g/mol
- Monoisotopic mass
- 317.23547923
Names & identifiers
- Preferred name
- N,N-Diethyl-2-(3,5-di-tert-butyl-4-oxocyclohexa-2,5-dienylidene)acetamide
- IUPAC
- 2-(3,5-ditert-butyl-4-oxocyclohexa-2,5-dien-1-ylidene)-N,N-diethylacetamide
Names & synonyms
SCHEMBL4455196XLUYBJZPUGOPSS-UHFFFAOYSA-NDiethyl (3,5-di-t-butyl-4-oxocyclohexa-2,5-dienylidene)acetamideN,N-Diethyl-2-(3,5-di-tert-butyl-4-oxocyclohexa-2,5-dienylidene)acetamide
Database identifiers
- PubChem CID
- 22019858
Properties
Computed structural properties
- XLogP
- 4.4
- Topological polar surface area
- 37.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 5
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 538
Related reactions
4 records
Compound notes
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