J66
Summary
| Name: | 2-oxidanylisoindole-1,3-dione |
| Formula: | C8 H5 N O3 |
| Formal charge: | 0 |
| Formula weight: | 163.13 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | 2-oxidanylisoindole-1,3-dione |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C8H5NO3/c10-7-5-3-1-2-4-6(5)8(11)9(7)12/h1-4,12H |
| InChIKey | InChI | 1.03 | CFMZSMGAMPBRBE-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | ON1C(=O)c2ccccc2C1=O |
| SMILES | CACTVS | 3.385 | ON1C(=O)c2ccccc2C1=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | c1ccc2c(c1)C(=O)N(C2=O)O |
| SMILES | OpenEye OEToolkits | 2.0.7 | c1ccc2c(c1)C(=O)N(C2=O)O |
