Basic information
- Standard SMILES
CCOC(=O)C(C(=O)NCc1ccc(Cl)cc1)C(=O)OCC- InChIKey
XVZNYMLUSJWQQO-UHFFFAOYSA-N- Molecular formula
- C15H18ClNO5
- Average molar mass
- 327.76 g/mol
Names & identifiers
- Preferred name
- Diethyl 2-(((4-Chlorobenzyl)amino)carbonyl)malonate
- IUPAC
- diethyl 2-[(4-chlorophenyl)methylcarbamoyl]propanedioate
Names & synonyms
SCHEMBL6286313XVZNYMLUSJWQQO-UHFFFAOYSA-NDB-408860Diethyl 2-(((4-Chlorobenzyl)amino)carbonyl)malonatediethyl 2-(((4-chlorobenzyl)amino) carbonyl)malonate2-[[[(4-chlorophenyl)methyl]amino]carbonyl]Propanedioic acid 1,3-diethyl ester390360-28-8
Database identifiers
- PubChem CID
- 22397146
Properties
Computed structural properties
- XLogP
- 2.5
- Topological polar surface area
- 81.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 9
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 375
Related reactions
8 records
Compound notes
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