Basic information
- Standard SMILES
CCOC(=O)c1cc2cc(-n3cnc(CO)c3)c([N+](=O)[O-])cc2nc1OCC- InChIKey
FIXQXPDDBKHMAF-UHFFFAOYSA-N- Molecular formula
- C18H18N4O6
- Average molar mass
- 386.4 g/mol
- Monoisotopic mass
- 386.12263431
Names & identifiers
- Preferred name
- Ethyl 2-ethoxy-6-(4-(hydroxymethyl)imidazole-1-yl)-7-nitroquinoline-3-carboxylate
- IUPAC
- ethyl 2-ethoxy-6-[4-(hydroxymethyl)imidazol-1-yl]-7-nitroquinoline-3-carboxylate
Names & synonyms
SCHEMBL6595960FIXQXPDDBKHMAF-UHFFFAOYSA-NEthyl 2-ethoxy-6-(4-(hydroxymethyl)imidazole-1-yl)-7-nitroquinoline-3-carboxylate
Database identifiers
- PubChem CID
- 9864967
Properties
Computed structural properties
- XLogP
- 1.8
- Topological polar surface area
- 132 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 7
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 559
Related reactions
3 records
Compound notes
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