nitro[?]dione
6-nitro-2,10-diazahexacyclo[11.11.1.02,11.04,9.014,19.021,25]pentacosa-1(24),4(9),5,7,10,12,14,16,18,21(25),22-undecaene-3,20-dione
Also Known As: nitro[?]dione|12-Nitronaphtho[1',2',3':4,5]quino[2,1-b]quinazoline-5,10-dione|12-Nitronaphtho[1',2',3':4,5]quinolino[2,1-b]quinazoline-5,10-dione|6-Nitro-2,10-diazahexacyclo[11.11.1.02,11.04,9.014,19.021,25]pentacosa-1(24),4(9),5,7,10,12,14,16,18,21(25),22-undecaene-3,20-dione
| Molecular Formula | C23H11N3O4 |
|---|---|
| Molecular Weight | 393.07495 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 95.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 0 |
| Exact Mass | 393.07495 |
| Monoisotopic Mass | 393.07495 |
| Heavy Atoms | 30 |
| Complexity | 874.0 |
Chemical Identifiers
| CAS Number | 81092-84-4 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C3=CC4=NC5=C(C=C(C=C5)[N+](=O)[O-])C(=O)N4C6=CC=CC(=C63)C2=O |
| InChIKey | KHQGRJFOQNWAIZ-UHFFFAOYSA-N |
Product Overview
nitro[?]dione (CAS 81092-84-4), with molecular formula C23H11N3O4 and molecular weight 393.07495 g/mol. IUPAC: 6-nitro-2,10-diazahexacyclo[11.11.1.02,11.04,9.014,19.021,25]pentacosa-1(24),4(9),5,7,10,12,14,16,18,21(25),22-undecaene-3,20-dione.
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