BY2
Summary
| Name: | [3-[(1~{R})-1-(dimethylamino)ethyl]-4-oxidanyl-phenyl] ~{N}-ethyl-~{N}-methyl-carbamate |
| Formula: | C14 H22 N2 O3 |
| Formal charge: | 0 |
| Formula weight: | 266.336 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.6 | [3-[(1~{R})-1-(dimethylamino)ethyl]-4-oxidanyl-phenyl] ~{N}-ethyl-~{N}-methyl-carbamate |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C14H22N2O3/c1-6-16(5)14(18)19-11-7-8-13(17)12(9-11)10(2)15(3)4/h7-10,17H,6H2,1-5H3/t10-/m1/s1 |
| InChIKey | InChI | 1.03 | QLWZODGBJZFYGE-SNVBAGLBSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CCN(C)C(=O)Oc1ccc(O)c(c1)[C@@H](C)N(C)C |
| SMILES | CACTVS | 3.385 | CCN(C)C(=O)Oc1ccc(O)c(c1)[CH](C)N(C)C |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | CCN(C)C(=O)Oc1ccc(c(c1)[C@@H](C)N(C)C)O |
| SMILES | OpenEye OEToolkits | 2.0.6 | CCN(C)C(=O)Oc1ccc(c(c1)C(C)N(C)C)O |
