Basic information
- Standard SMILES
O=C(O)C=Cc1cccc(NC(=O)c2ccc(Oc3ccccc3)o2)c1- InChIKey
CYTSHVCSSIGXCB-UHFFFAOYSA-N- Molecular formula
- C20H15NO5
- Average molar mass
- 349.3 g/mol
- Monoisotopic mass
- 349.09502258
Names & identifiers
- Preferred name
- 3-{3-[(5-Phenoxy-furan-2-carbonyl)-amino]-phenyl}-acrylic acid
- IUPAC
- 3-[3-[(5-phenoxyfuran-2-carbonyl)amino]phenyl]prop-2-enoic acid
Names & synonyms
SCHEMBL2845017CYTSHVCSSIGXCB-UHFFFAOYSA-N3-{3-[(5-Phenoxy-furan-2-carbonyl)-amino]-phenyl}-acrylic acid
Database identifiers
- PubChem CID
- 68413660
Properties
Computed structural properties
- XLogP
- 4
- Topological polar surface area
- 88.8 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 6
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 514
Related reactions
1 records
Compound notes
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