Basic information
- Standard SMILES
CCOC(=O)C(N=C(c1ccccc1)c1cc(Cl)ccc1O)C(=O)OCC- InChIKey
OCSOJYOCAFCUOW-UHFFFAOYSA-N- Molecular formula
- C20H20ClNO5
- Average molar mass
- 389.8 g/mol
Names & identifiers
- Preferred name
- [(5-Chloro-2-hydroxy-alpha-phenylbenzyliden)amino] malonic acid diethyl ester
- IUPAC
- diethyl 2-[[(5-chloro-2-hydroxyphenyl)-phenylmethylidene]amino]propanedioate
Names & synonyms
SCHEMBL11632832OCSOJYOCAFCUOW-UHFFFAOYSA-N[(5-chloro-2-hydroxy-alpha-phenylbenzyliden)amino] malonic acid diethyl ester
Database identifiers
- PubChem CID
- 136388409
Properties
Computed structural properties
- XLogP
- 4.6
- Topological polar surface area
- 85.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 9
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 514
Related reactions
7 records
Compound notes
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