UNC
Summary
| Name: | 5-AMINO-6-NITROPYRIMIDINE-2,4(1H,3H)-DIONE |
| Synonyms: | 5-AMINO 6-NITRO URACIL |
| Formula: | C4 H4 N4 O4 |
| Formal charge: | 0 |
| Formula weight: | 172.099 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 10.04 | 5-amino-6-nitropyrimidine-2,4(1H,3H)-dione |
| OpenEye OEToolkits | 1.5.0 | 5-amino-6-nitro-1H-pyrimidine-2,4-dione |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | O=[N+]([O-])C1=C(C(=O)NC(=O)N1)N |
| SMILES_CANONICAL | CACTVS | 3.341 | NC1=C(NC(=O)NC1=O)[N+]([O-])=O |
| SMILES | CACTVS | 3.341 | NC1=C(NC(=O)NC1=O)[N+]([O-])=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | C1(=C(NC(=O)NC1=O)[N+](=O)[O-])N |
| SMILES | OpenEye OEToolkits | 1.5.0 | C1(=C(NC(=O)NC1=O)[N+](=O)[O-])N |
| InChI | InChI | 1.03 | InChI=1S/C4H4N4O4/c5-1-2(8(11)12)6-4(10)7-3(1)9/h5H2,(H2,6,7,9,10) |
| InChIKey | InChI | 1.03 | CLOSWQFGCBFNCK-UHFFFAOYSA-N |
