JBK
Summary
| Name: | 2-azanyl-3-nitro-phenol |
| Formula: | C6 H6 N2 O3 |
| Formal charge: | 0 |
| Formula weight: | 154.123 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | 2-azanyl-3-nitro-phenol |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C6H6N2O3/c7-6-4(8(10)11)2-1-3-5(6)9/h1-3,9H,7H2 |
| InChIKey | InChI | 1.03 | KUCWUAFNGCMZDB-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | Nc1c(O)cccc1[N+]([O-])=O |
| SMILES | CACTVS | 3.385 | Nc1c(O)cccc1[N+]([O-])=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | c1cc(c(c(c1)O)N)[N+](=O)[O-] |
| SMILES | OpenEye OEToolkits | 2.0.7 | c1cc(c(c(c1)O)N)[N+](=O)[O-] |
