NBZ
Summary
| Name: | NITROBENZENE |
| Formula: | C6 H5 N O2 |
| Formal charge: | 0 |
| Formula weight: | 123.109 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 10.04 | nitrobenzene |
| OpenEye OEToolkits | 1.5.0 | nitrobenzene |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | [O-][N+](=O)c1ccccc1 |
| SMILES_CANONICAL | CACTVS | 3.341 | [O-][N+](=O)c1ccccc1 |
| SMILES | CACTVS | 3.341 | [O-][N+](=O)c1ccccc1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | c1ccc(cc1)[N+](=O)[O-] |
| SMILES | OpenEye OEToolkits | 1.5.0 | c1ccc(cc1)[N+](=O)[O-] |
| InChI | InChI | 1.03 | InChI=1S/C6H5NO2/c8-7(9)6-4-2-1-3-5-6/h1-5H |
| InChIKey | InChI | 1.03 | LQNUZADURLCDLV-UHFFFAOYSA-N |
