2-[2-(Furan-2-yl)-1-nitroethenyl]-1-(oxolan-3-ylmethyl)-4,5-dihydroimidazole
Basic information
- Standard SMILES
O=[N+]([O-])C(=Cc1ccco1)C1=NCCN1CC1CCOC1- InChIKey
UMCJMKOXLRQZFR-UHFFFAOYSA-N- Molecular formula
- C14H17N3O4
- Average molar mass
- 291.3 g/mol
- Monoisotopic mass
- 291.12190603
Names & identifiers
- Preferred name
- 2-[2-(Furan-2-yl)-1-nitroethenyl]-1-(oxolan-3-ylmethyl)-4,5-dihydroimidazole
- IUPAC
- 2-[2-(furan-2-yl)-1-nitroethenyl]-1-(oxolan-3-ylmethyl)-4,5-dihydroimidazole
Names & synonyms
SCHEMBL1250464
Database identifiers
- PubChem CID
- 66965664
Properties
Computed structural properties
- XLogP
- 0.9
- Topological polar surface area
- 83.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 458
Related reactions
1 records
Compound notes
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