3IS
Summary
| Name: | 5-chloranyl-1,3-dihydroindol-2-one |
| Formula: | C8 H6 Cl N O |
| Formal charge: | 0 |
| Formula weight: | 167.592 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | 5-chloranyl-1,3-dihydroindol-2-one |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C8H6ClNO/c9-6-1-2-7-5(3-6)4-8(11)10-7/h1-3H,4H2,(H,10,11) |
| InChIKey | InChI | 1.03 | WWJLCYHYLZZXBE-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | Clc1ccc2NC(=O)Cc2c1 |
| SMILES | CACTVS | 3.385 | Clc1ccc2NC(=O)Cc2c1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | c1cc2c(cc1Cl)CC(=O)N2 |
| SMILES | OpenEye OEToolkits | 2.0.7 | c1cc2c(cc1Cl)CC(=O)N2 |
