W9M
Summary
| Name: | 3-(3,4-dichlorophenyl)-1,1-dimethyl-urea |
| Formula: | C9 H10 Cl2 N2 O |
| Formal charge: | 0 |
| Formula weight: | 233.094 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | 3-(3,4-dichlorophenyl)-1,1-dimethylurea |
| OpenEye OEToolkits | 1.9.2 | 3-(3,4-dichlorophenyl)-1,1-dimethyl-urea |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | Clc1ccc(NC(=O)N(C)C)cc1Cl |
| InChI | InChI | 1.03 | InChI=1S/C9H10Cl2N2O/c1-13(2)9(14)12-6-3-4-7(10)8(11)5-6/h3-5H,1-2H3,(H,12,14) |
| InChIKey | InChI | 1.03 | XMTQQYYKAHVGBJ-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CN(C)C(=O)Nc1ccc(Cl)c(Cl)c1 |
| SMILES | CACTVS | 3.385 | CN(C)C(=O)Nc1ccc(Cl)c(Cl)c1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.9.2 | CN(C)C(=O)Nc1ccc(c(c1)Cl)Cl |
| SMILES | OpenEye OEToolkits | 1.9.2 | CN(C)C(=O)Nc1ccc(c(c1)Cl)Cl |
