V9I
Summary
| Name: | ethyl (3S)-3-(methoxycarbamoyl)piperidine-1-carboxylate |
| Formula: | C10 H18 N2 O4 |
| Formal charge: | 0 |
| Formula weight: | 230.261 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | ethyl (3S)-3-(methoxycarbamoyl)piperidine-1-carboxylate |
| OpenEye OEToolkits | 2.0.7 | ethyl (3~{S})-3-(methoxycarbamoyl)piperidine-1-carboxylate |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | CONC(=O)C1CCCN(C1)C(=O)OCC |
| InChI | InChI | 1.06 | InChI=1S/C10H18N2O4/c1-3-16-10(14)12-6-4-5-8(7-12)9(13)11-15-2/h8H,3-7H2,1-2H3,(H,11,13)/t8-/m0/s1 |
| InChIKey | InChI | 1.06 | CUKXABWTVVSDEP-QMMMGPOBSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CCOC(=O)N1CCC[C@@H](C1)C(=O)NOC |
| SMILES | CACTVS | 3.385 | CCOC(=O)N1CCC[CH](C1)C(=O)NOC |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | CCOC(=O)N1CCC[C@@H](C1)C(=O)NOC |
| SMILES | OpenEye OEToolkits | 2.0.7 | CCOC(=O)N1CCCC(C1)C(=O)NOC |
