Basic information
- Standard SMILES
CCOC(=O)C=CNC(=O)Nc1ccc(Cl)c(C(=O)OCC)c1- InChIKey
UCTCAINNLQKIAB-UHFFFAOYSA-N- Molecular formula
- C15H17ClN2O5
- Average molar mass
- 340.76 g/mol
Names & identifiers
- Preferred name
- Ethyl 2-chloro-5-{3-[2-(ethoxycarbonyl)vinyl]ureido}-benzoate
- IUPAC
- ethyl 2-chloro-5-[(3-ethoxy-3-oxoprop-1-enyl)carbamoylamino]benzoate
Names & synonyms
SCHEMBL10648473UCTCAINNLQKIAB-UHFFFAOYSA-Nethyl 2-chloro-5-{3-[2-(ethoxycarbonyl)vinyl]ureido}-benzoate
Database identifiers
- PubChem CID
- 54346642
Properties
Computed structural properties
- XLogP
- 2.7
- Topological polar surface area
- 93.7 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 8
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 455
Related reactions
5 records
Compound notes
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