7NX
Summary
| Name: | cyclohexylmethyl hydrogen carbonate |
| Formula: | C8 H14 O3 |
| Formal charge: | 0 |
| Formula weight: | 158.195 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.6 | cyclohexylmethyl hydrogen carbonate |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C8H14O3/c9-8(10)11-6-7-4-2-1-3-5-7/h7H,1-6H2,(H,9,10) |
| InChIKey | InChI | 1.03 | GPTIZNPODRMHFN-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | OC(=O)OCC1CCCCC1 |
| SMILES | CACTVS | 3.385 | OC(=O)OCC1CCCCC1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | C1CCC(CC1)COC(=O)O |
| SMILES | OpenEye OEToolkits | 2.0.6 | C1CCC(CC1)COC(=O)O |
