6SV
Summary
| Name: | 1-cyclohexyl-3-[[(2~{R})-oxolan-2-yl]methyl]urea |
| Formula: | C12 H22 N2 O2 |
| Formal charge: | 0 |
| Formula weight: | 226.315 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.5 | 1-cyclohexyl-3-[[(2~{R})-oxolan-2-yl]methyl]urea |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C12H22N2O2/c15-12(13-9-11-7-4-8-16-11)14-10-5-2-1-3-6-10/h10-11H,1-9H2,(H2,13,14,15)/t11-/m1/s1 |
| InChIKey | InChI | 1.03 | RYUZWZOTJULRNS-LLVKDONJSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | O=C(NC[C@H]1CCCO1)NC2CCCCC2 |
| SMILES | CACTVS | 3.385 | O=C(NC[CH]1CCCO1)NC2CCCCC2 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.5 | C1CCC(CC1)NC(=O)NC[C@H]2CCCO2 |
| SMILES | OpenEye OEToolkits | 2.0.5 | C1CCC(CC1)NC(=O)NCC2CCCO2 |
