Basic information
- CAS
870464-25-8- Standard SMILES
CCOc1c(Cl)cc(C=NNC(=O)c2cc3ccccc3cc2O)cc1OC- InChIKey
CCKSCQWYJBTJOC-UHFFFAOYSA-N- Molecular formula
- C21H19ClN2O4
- Average molar mass
- 398.8 g/mol
- Monoisotopic mass
- 398.1033348
Names & identifiers
- Preferred name
- 3-Hydroxy-2-naphthalenecarboxylic acid 2-[(3-chloro-4-ethoxy-5-methoxyphenyl)methylene]hydrazide
- IUPAC
- N-[(3-chloro-4-ethoxy-5-methoxyphenyl)methylideneamino]-3-hydroxynaphthalene-2-carboxamide
Names & synonyms
DTXSID9011163023-Hydroxy-2-naphthalenecarboxylic acid 2-[(3-chloro-4-ethoxy-5-methoxyphenyl)methylene]hydrazide870464-25-8N'-[(3-chloro-4-ethoxy-5-methoxyphenyl)methylidene]-3-hydroxynaphthalene-2-carbohydrazide
Database identifiers
- CAS
870464-25-8- PubChem CID
- 3991008
- DTXSID
DTXSID901116302
Properties
Computed structural properties
- XLogP
- 5.2
- Topological polar surface area
- 80.2 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 6
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 546
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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