6R7
Summary
| Name: | 5-nitrosalicylic acid |
| Synonyms: | 5-nitro-2-oxidanyl-benzoic acid |
| Formula: | C7 H5 N O5 |
| Formal charge: | 0 |
| Formula weight: | 183.118 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.5 | 5-nitro-2-oxidanyl-benzoic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C7H5NO5/c9-6-2-1-4(8(12)13)3-5(6)7(10)11/h1-3,9H,(H,10,11) |
| InChIKey | InChI | 1.03 | PPDRLQLKHRZIJC-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | OC(=O)c1cc(ccc1O)[N+]([O-])=O |
| SMILES | CACTVS | 3.385 | OC(=O)c1cc(ccc1O)[N+]([O-])=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.5 | c1cc(c(cc1[N+](=O)[O-])C(=O)O)O |
| SMILES | OpenEye OEToolkits | 2.0.5 | c1cc(c(cc1[N+](=O)[O-])C(=O)O)O |
