Basic information
- Standard SMILES
COc1cc2nccc(Oc3ccc(N)c([N+](=O)[O-])c3)c2cc1OC- InChIKey
RLAZUBWVKQILPD-UHFFFAOYSA-N- Molecular formula
- C17H15N3O5
- Average molar mass
- 341.32 g/mol
- Monoisotopic mass
- 341.10117059
Names & identifiers
- Preferred name
- 4-[(6,7-Dimethoxy-4-quinolyl)oxy]-2-nitroaniline
- IUPAC
- 4-(6,7-dimethoxyquinolin-4-yl)oxy-2-nitroaniline
Names & synonyms
SCHEMBL5205515RLAZUBWVKQILPD-UHFFFAOYSA-NDB-4258094-[(6,7-Dimethoxy-4-quinolyl)oxy]-2-nitroaniline4-[(6,7-Dimethoxy-4-quinolinyl)oxy]-2-nitrobenzenamine286371-48-0
Database identifiers
- PubChem CID
- 21890730
Properties
Computed structural properties
- XLogP
- 3.4
- Topological polar surface area
- 112 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 4
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 460
Related reactions
20 records
Compound notes
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