ZCQ
Summary
| Name: | 3-nitrophenol |
| Formula: | C6 H5 N O3 |
| Formal charge: | 0 |
| Formula weight: | 139.109 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | 3-nitrophenol |
| OpenEye OEToolkits | 1.7.6 | 3-nitrophenol |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | O=[N+]([O-])c1cccc(O)c1 |
| InChI | InChI | 1.03 | InChI=1S/C6H5NO3/c8-6-3-1-2-5(4-6)7(9)10/h1-4,8H |
| InChIKey | InChI | 1.03 | RTZZCYNQPHTPPL-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.370 | Oc1cccc(c1)[N+]([O-])=O |
| SMILES | CACTVS | 3.370 | Oc1cccc(c1)[N+]([O-])=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.6 | c1cc(cc(c1)O)[N+](=O)[O-] |
| SMILES | OpenEye OEToolkits | 1.7.6 | c1cc(cc(c1)O)[N+](=O)[O-] |
