3IE
Summary
| Name: | (2~{S})-1-methoxypropan-2-amine |
| Formula: | C4 H11 N O |
| Formal charge: | 0 |
| Formula weight: | 89.136 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | (2~{S})-1-methoxypropan-2-amine |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C4H11NO/c1-4(5)3-6-2/h4H,3,5H2,1-2H3/t4-/m0/s1 |
| InChIKey | InChI | 1.03 | NXMXETCTWNXSFG-BYPYZUCNSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | COC[C@H](C)N |
| SMILES | CACTVS | 3.385 | COC[CH](C)N |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | C[C@@H](COC)N |
| SMILES | OpenEye OEToolkits | 2.0.7 | CC(COC)N |
