Basic information
- Standard SMILES
COc1ccc(Nc2cccc3c2C(=O)c2c(cccc2[N+](=O)[O-])C3=O)cc1- InChIKey
NFOXGPBLLRYDNS-UHFFFAOYSA-N- Molecular formula
- C21H14N2O5
- Average molar mass
- 374.3 g/mol
Names & identifiers
- Preferred name
- 1-p-Anisidino-8-nitro-anthraquinone
- IUPAC
- 1-(4-methoxyanilino)-8-nitroanthracene-9,10-dione
Names & synonyms
SCHEMBL11593437NFOXGPBLLRYDNS-UHFFFAOYSA-N1-p-anisidino-8-nitro-anthraquinone
Database identifiers
- PubChem CID
- 20316486
Properties
Computed structural properties
- XLogP
- 4.8
- Topological polar surface area
- 101 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 3
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 625
Related reactions
3 records
Compound notes
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