NID
Summary
| Name: | 4-NITRO-INDEN-1-ONE |
| Formula: | C9 H5 N O3 |
| Formal charge: | 0 |
| Formula weight: | 175.141 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 10.04 | 4-nitro-1H-inden-1-one |
| OpenEye OEToolkits | 1.5.0 | 4-nitroinden-1-one |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | [O-][N+](=O)c1cccc2c1C=CC2=O |
| SMILES_CANONICAL | CACTVS | 3.341 | [O-][N+](=O)c1cccc2C(=O)C=Cc12 |
| SMILES | CACTVS | 3.341 | [O-][N+](=O)c1cccc2C(=O)C=Cc12 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | c1cc2c(c(c1)[N+](=O)[O-])C=CC2=O |
| SMILES | OpenEye OEToolkits | 1.5.0 | c1cc2c(c(c1)[N+](=O)[O-])C=CC2=O |
| InChI | InChI | 1.03 | InChI=1S/C9H5NO3/c11-9-5-4-6-7(9)2-1-3-8(6)10(12)13/h1-5H |
| InChIKey | InChI | 1.03 | UUNZJPCKMDLQPO-UHFFFAOYSA-N |
