VYK
Summary
| Name: | N~2~-[(3-chlorophenyl)methyl]-N~2~-methylglycinamide |
| Formula: | C10 H13 Cl N2 O |
| Formal charge: | 0 |
| Formula weight: | 212.676 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | N~2~-[(3-chlorophenyl)methyl]-N~2~-methylglycinamide |
| OpenEye OEToolkits | 2.0.7 | 2-[(3-chlorophenyl)methyl-methyl-amino]ethanamide |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | Clc1cc(CN(C)CC(N)=O)ccc1 |
| InChI | InChI | 1.06 | InChI=1S/C10H13ClN2O/c1-13(7-10(12)14)6-8-3-2-4-9(11)5-8/h2-5H,6-7H2,1H3,(H2,12,14) |
| InChIKey | InChI | 1.06 | RIKLZHNBGITIMS-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CN(CC(N)=O)Cc1cccc(Cl)c1 |
| SMILES | CACTVS | 3.385 | CN(CC(N)=O)Cc1cccc(Cl)c1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | CN(Cc1cccc(c1)Cl)CC(=O)N |
| SMILES | OpenEye OEToolkits | 2.0.7 | CN(Cc1cccc(c1)Cl)CC(=O)N |
