A1CVN
Summary
| Name: | N'-(2,3-dichlorophenyl)-N,N-dimethylurea |
| Formula: | C9 H10 Cl2 N2 O |
| Formal charge: | 0 |
| Formula weight: | 233.094 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 14.52 | N'-(2,3-dichlorophenyl)-N,N-dimethylurea |
| OpenEye OEToolkits | 3.1.0.0 | 3-[2,3-bis(chloranyl)phenyl]-1,1-dimethyl-urea |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 14.52 | Clc1c(NC(=O)N(C)C)cccc1Cl |
| InChI | InChI | 1.06 | InChI=1S/C9H10Cl2N2O/c1-13(2)9(14)12-7-5-3-4-6(10)8(7)11/h3-5H,1-2H3,(H,12,14) |
| InChIKey | InChI | 1.06 | ZVPQMESWKIQHGS-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CN(C)C(=O)Nc1cccc(Cl)c1Cl |
| SMILES | CACTVS | 3.385 | CN(C)C(=O)Nc1cccc(Cl)c1Cl |
| SMILES_CANONICAL | OpenEye OEToolkits | 3.1.0.0 | CN(C)C(=O)Nc1cccc(c1Cl)Cl |
| SMILES | OpenEye OEToolkits | 3.1.0.0 | CN(C)C(=O)Nc1cccc(c1Cl)Cl |
