Basic information
- Standard SMILES
O=[N+]([O-])c1ccc(-c2ccc(C=Nc3cc([N+](=O)[O-])ccc3O)o2)cc1- InChIKey
KXEMFGQKTKMYHB-UHFFFAOYSA-N- Molecular formula
- C17H11N3O6
- Average molar mass
- 353.28 g/mol
Names & identifiers
- Preferred name
- 4-Nitro-2-{[5-(4-nitrophenyl)furan-2-yl]methyleneamino}phenol
- IUPAC
- 4-nitro-2-[[5-(4-nitrophenyl)furan-2-yl]methylideneamino]phenol
Names & synonyms
SCHEMBL3684656SCHEMBL3763988KXEMFGQKTKMYHB-UHFFFAOYSA-N4-nitro-2-{[5-(4-nitrophenyl)furan-2-yl]methyleneamino}phenol
Database identifiers
- PubChem CID
- 86648432
Properties
Computed structural properties
- XLogP
- 3.6
- Topological polar surface area
- 137 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 3
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 538
Related reactions
1 records
Linked notes
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