Basic information
- Standard SMILES
Cc1cc(C)c(C2=C(OC(=O)C(C)(C)C)C/C(=C\c3ccoc3)C2=O)c(C)c1- InChIKey
VQLBGWZQQPLACY-WOJGMQOQSA-N- Molecular formula
- C24H26O4
- Average molar mass
- 378.5 g/mol
Names & identifiers
- Preferred name
- 2,2-dimethyl-propionic acid 4-[1-furan-3-yl-meth-(E)-ylidene]-3-oxo-2-(2,4,6-trimethyl-phenyl)-cyclopent-1-enyl ester
- IUPAC
- [(4E)-4-(furan-3-ylmethylidene)-3-oxo-2-(2,4,6-trimethylphenyl)cyclopenten-1-yl] 2,2-dimethylpropanoate
Names & synonyms
SCHEMBL427554VQLBGWZQQPLACY-WOJGMQOQSA-N2,2-dimethyl-propionic acid 4-[1-furan-3-yl-meth-(E)-ylidene]-3-oxo-2-(2,4,6-trimethyl-phenyl)-cyclopent-1-enyl ester
Database identifiers
- PubChem CID
- 66683028
Properties
Computed structural properties
- XLogP
- 5.3
- Topological polar surface area
- 56.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 682
Related reactions
1 records
Compound notes
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