BXT
Summary
| Name: | (2~{S})-2-azanyl-3-[ethyl(methyl)carbamoyl]oxy-propanoic acid |
| Formula: | C7 H14 N2 O4 |
| Formal charge: | 0 |
| Formula weight: | 190.197 Da |
| Component type: | L-peptide linking |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.6 | (2~{S})-2-azanyl-3-[ethyl(methyl)carbamoyl]oxy-propanoic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C7H14N2O4/c1-3-9(2)7(12)13-4-5(8)6(10)11/h5H,3-4,8H2,1-2H3,(H,10,11)/t5-/m0/s1 |
| InChIKey | InChI | 1.03 | UYBASDIYBHKZCX-YFKPBYRVSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CCN(C)C(=O)OC[C@H](N)C(O)=O |
| SMILES | CACTVS | 3.385 | CCN(C)C(=O)OC[CH](N)C(O)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | CCN(C)C(=O)OC[C@@H](C(=O)O)N |
| SMILES | OpenEye OEToolkits | 2.0.6 | CCN(C)C(=O)OCC(C(=O)O)N |
