V2U
Summary
| Name: | 2-chloro-N-(3,5-dimethoxyphenyl)acetamide |
| Formula: | C10 H12 Cl N O3 |
| Formal charge: | 0 |
| Formula weight: | 229.66 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | 2-chloro-N-(3,5-dimethoxyphenyl)acetamide |
| OpenEye OEToolkits | 2.0.7 | 2-chloranyl-~{N}-(3,5-dimethoxyphenyl)ethanamide |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | COc1cc(cc(OC)c1)NC(=O)CCl |
| InChI | InChI | 1.06 | InChI=1S/C10H12ClNO3/c1-14-8-3-7(12-10(13)6-11)4-9(5-8)15-2/h3-5H,6H2,1-2H3,(H,12,13) |
| InChIKey | InChI | 1.06 | OAFXUKHPQCSRPT-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | COc1cc(NC(=O)CCl)cc(OC)c1 |
| SMILES | CACTVS | 3.385 | COc1cc(NC(=O)CCl)cc(OC)c1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | COc1cc(cc(c1)OC)NC(=O)CCl |
| SMILES | OpenEye OEToolkits | 2.0.7 | COc1cc(cc(c1)OC)NC(=O)CCl |
