Basic information
- CAS
5537-53-1- Standard SMILES
Cc1ccccc1NCC(=O)N/N=C\c1ccc(Cl)c([N+](=O)[O-])c1- InChIKey
GGPUVYVGOAXYQN-OCKHKDLRSA-N- Molecular formula
- C16H15ClN4O3
- Average molar mass
- 346.77 g/mol
- Monoisotopic mass
- 346.083268
Names & identifiers
- Preferred name
- N'-(4-chloro-3-nitrobenzylidene)-2-[(2-methylphenyl)amino]acetohydrazide
- IUPAC
- N-[(Z)-(4-chloro-3-nitrophenyl)methylideneamino]-2-(2-methylanilino)acetamide
Names & synonyms
ZINC00060094DTXSID50416910CCG-10461BIM-0023125.P001SR-01000211969SR-01000211969-1N'-(4-chloro-3-nitrobenzylidene)-2-[(2-methylphenyl)amino]acetohydrazideN'-[(Z)-(4-Chloro-3-nitrophenyl)methylidene]-2-(2-methylanilino)acetohydrazide
Database identifiers
- CAS
5537-53-1- PubChem CID
- 5340412
- DTXSID
DTXSID50416910
Properties
Computed structural properties
- XLogP
- 3.7
- Topological polar surface area
- 99.3 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 5
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 469
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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