HR8
Summary
| Name: | 5-chloranyl-2-methoxy-~{N}-(2-methylpropyl)benzamide |
| Formula: | C12 H16 Cl N O2 |
| Formal charge: | 0 |
| Formula weight: | 241.714 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.6 | 5-chloranyl-2-methoxy-~{N}-(2-methylpropyl)benzamide |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C12H16ClNO2/c1-8(2)7-14-12(15)10-6-9(13)4-5-11(10)16-3/h4-6,8H,7H2,1-3H3,(H,14,15) |
| InChIKey | InChI | 1.03 | GSFUSGKNYXRUQM-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | COc1ccc(Cl)cc1C(=O)NCC(C)C |
| SMILES | CACTVS | 3.385 | COc1ccc(Cl)cc1C(=O)NCC(C)C |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | CC(C)CNC(=O)c1cc(ccc1OC)Cl |
| SMILES | OpenEye OEToolkits | 2.0.6 | CC(C)CNC(=O)c1cc(ccc1OC)Cl |
