Molecule ID: mol15383
SMILES: O=C(CC(=O)c1ccc([N+](=O)[O-])cc1)Nc1ccccc1
InChI: InChI=1S/C15H12N2O4/c18-14(11-6-8-13(9-7-11)17(20)21)10-15(19)16-12-4-2-1-3-5-12/h1-9H,10H2,(H,16,19)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 8.70 | OCHEM | 0 » -1 |
| 8.70 | Datawarrior | 0 » -1 |