H0D
Summary
| Name: | N-(4-chlorophenyl)-N'-[(2R)-1-hydroxybutan-2-yl]urea |
| Formula: | C11 H15 Cl N2 O2 |
| Formal charge: | 0 |
| Formula weight: | 242.702 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | N-(4-chlorophenyl)-N'-[(2R)-1-hydroxybutan-2-yl]urea |
| OpenEye OEToolkits | 2.0.6 | 1-(4-chlorophenyl)-3-[(2~{R})-1-oxidanylbutan-2-yl]urea |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | N(C(CO)CC)C(=O)Nc1ccc(cc1)Cl |
| InChI | InChI | 1.03 | InChI=1S/C11H15ClN2O2/c1-2-9(7-15)13-11(16)14-10-5-3-8(12)4-6-10/h3-6,9,15H,2,7H2,1H3,(H2,13,14,16)/t9-/m1/s1 |
| InChIKey | InChI | 1.03 | WLAQZHZJODLWGO-SECBINFHSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CC[C@H](CO)NC(=O)Nc1ccc(Cl)cc1 |
| SMILES | CACTVS | 3.385 | CC[CH](CO)NC(=O)Nc1ccc(Cl)cc1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | CC[C@H](CO)NC(=O)Nc1ccc(cc1)Cl |
| SMILES | OpenEye OEToolkits | 2.0.6 | CCC(CO)NC(=O)Nc1ccc(cc1)Cl |
