Basic information
- Standard SMILES
Cc1oc(-c2ccccc2)nc1COc1ccc2cc(/C=C/C=O)oc2c1- InChIKey
DULNCIMPBYLQTG-VMPITWQZSA-N- Molecular formula
- C22H17NO4
- Average molar mass
- 359.4 g/mol
Names & identifiers
- Preferred name
- (E)-3-[6-(5-methyl-2-phenyl-4-oxazolylmethoxy)-2-benzofuranyl]acrolein
- IUPAC
- (E)-3-[6-[(5-methyl-2-phenyl-1,3-oxazol-4-yl)methoxy]-1-benzofuran-2-yl]prop-2-enal
Names & synonyms
SCHEMBL8139624DULNCIMPBYLQTG-VMPITWQZSA-N(E)-3-[6-(5-methyl-2-phenyl-4-oxazolylmethoxy)-2-benzofuranyl]acrolein
Database identifiers
- PubChem CID
- 19694378
Properties
Computed structural properties
- XLogP
- 4.2
- Topological polar surface area
- 65.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 6
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 518
Related reactions
1 records
Linked notes
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