1P8
Summary
| Name: | 6-bromo-1,3-dihydro-2H-indol-2-one |
| Formula: | C8 H6 Br N O |
| Formal charge: | 0 |
| Formula weight: | 212.043 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | 6-bromo-1,3-dihydro-2H-indol-2-one |
| OpenEye OEToolkits | 1.7.6 | 6-bromanyl-1,3-dihydroindol-2-one |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | Brc1ccc2c(c1)NC(=O)C2 |
| InChI | InChI | 1.03 | InChI=1S/C8H6BrNO/c9-6-2-1-5-3-8(11)10-7(5)4-6/h1-2,4H,3H2,(H,10,11) |
| InChIKey | InChI | 1.03 | JARRYVQFBQVOBE-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.370 | Brc1ccc2CC(=O)Nc2c1 |
| SMILES | CACTVS | 3.370 | Brc1ccc2CC(=O)Nc2c1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.6 | c1cc2c(cc1Br)NC(=O)C2 |
| SMILES | OpenEye OEToolkits | 1.7.6 | c1cc2c(cc1Br)NC(=O)C2 |
