NXA
Summary
| Name: | N-CARBOXYALANINE |
| Formula: | C4 H7 N O4 |
| Formal charge: | 0 |
| Formula weight: | 133.103 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 10.04 | N-carboxy-L-alanine |
| OpenEye OEToolkits | 1.5.0 | (2S)-2-(carboxyamino)propanoic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | O=C(O)C(NC(=O)O)C |
| SMILES_CANONICAL | CACTVS | 3.341 | C[C@H](NC(O)=O)C(O)=O |
| SMILES | CACTVS | 3.341 | C[CH](NC(O)=O)C(O)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | C[C@@H](C(=O)O)NC(=O)O |
| SMILES | OpenEye OEToolkits | 1.5.0 | CC(C(=O)O)NC(=O)O |
| InChI | InChI | 1.03 | InChI=1S/C4H7NO4/c1-2(3(6)7)5-4(8)9/h2,5H,1H3,(H,6,7)(H,8,9)/t2-/m0/s1 |
| InChIKey | InChI | 1.03 | JCVPWRQVQNVNGU-REOHCLBHSA-N |
