8PJ
Summary
Name: | 3-nitropyridin-2-ol |
Formula: | C5 H4 N2 O3 |
Formal charge: | 0 |
Formula weight: | 140.097 Da |
Component type: | NON-POLYMER |
Chemical Identifiers
Program | Version | Name |
OpenEye OEToolkits | 2.0.6 | 3-nitropyridin-2-ol |
Chemical Descriptors
Type | Program | Version | Descriptor |
InChI | InChI | 1.03 | InChI=1S/C5H4N2O3/c8-5-4(7(9)10)2-1-3-6-5/h1-3H,(H,6,8) |
InChIKey | InChI | 1.03 | BOAFCICMVMFLIT-UHFFFAOYSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | Oc1ncccc1[N+]([O-])=O |
SMILES | CACTVS | 3.385 | Oc1ncccc1[N+]([O-])=O |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | c1cc(c(nc1)O)[N+](=O)[O-] |
SMILES | OpenEye OEToolkits | 2.0.6 | c1cc(c(nc1)O)[N+](=O)[O-] |