72S
Summary
| Name: | 7-methyl-1~{H}-indole-2,3-dione |
| Formula: | C9 H7 N O2 |
| Formal charge: | 0 |
| Formula weight: | 161.157 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.5 | 7-methyl-1~{H}-indole-2,3-dione |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C9H7NO2/c1-5-3-2-4-6-7(5)10-9(12)8(6)11/h2-4H,1H3,(H,10,11,12) |
| InChIKey | InChI | 1.03 | UEHZKEABUOAZSH-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | Cc1cccc2C(=O)C(=O)Nc12 |
| SMILES | CACTVS | 3.385 | Cc1cccc2C(=O)C(=O)Nc12 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.5 | Cc1cccc2c1NC(=O)C2=O |
| SMILES | OpenEye OEToolkits | 2.0.5 | Cc1cccc2c1NC(=O)C2=O |
