Basic information
- Standard SMILES
CCC(=CC(CNC(=O)c1cccnc1)=NO)C(C)[N+](=O)[O-]- InChIKey
KIWSYRHAAPLJFJ-UHFFFAOYSA-N- Molecular formula
- C14H18N4O4
- Average molar mass
- 306.32 g/mol
- Monoisotopic mass
- 306.13280507
Names & identifiers
- Preferred name
- N-(4-ethyl-2-hydroxyimino-5-nitro-3-hexen-1-yl)-3-pyridinecarboxamide
- IUPAC
- N-(4-ethyl-2-hydroxyimino-5-nitrohex-3-enyl)pyridine-3-carboxamide
Names & synonyms
nor-4SCHEMBL3122760N-((2Z,3E)-4-Ethyl-2-(hydroxyimino)-5-nitrohex-3-en-1-yl)nicotinamideKIWSYRHAAPLJFJ-UHFFFAOYSA-NN-[(2Z,3E)-4-ETHYL-2-(HYDROXYIMINO)-5-NITROHEX-3-EN-1-YL]PYRIDINE-3-CARBOXAMIDEN-(4-ethyl-2-hydroxyimino-5-nitro-3-hexen-1-yl)-3-pyridinecarboxamide
Database identifiers
- PubChem CID
- 4532
Properties
Computed structural properties
- XLogP
- 1.8
- Topological polar surface area
- 120 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 6
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 456
Related reactions
3 records
Compound notes
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