URP
Summary
| Name: | N-(AMINOCARBONYL)-BETA-ALANINE |
| Synonyms: | N-CARBAMYL-BETA-ALANINE BETA-UREIDOPROPIONATE |
| Formula: | C4 H8 N2 O3 |
| Formal charge: | 0 |
| Formula weight: | 132.118 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 10.04 | N-carbamoyl-beta-alanine |
| OpenEye OEToolkits | 1.5.0 | 3-(aminocarbonylamino)propanoic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | O=C(O)CCNC(=O)N |
| SMILES_CANONICAL | CACTVS | 3.341 | NC(=O)NCCC(O)=O |
| SMILES | CACTVS | 3.341 | NC(=O)NCCC(O)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | C(CNC(=O)N)C(=O)O |
| SMILES | OpenEye OEToolkits | 1.5.0 | C(CNC(=O)N)C(=O)O |
| InChI | InChI | 1.03 | InChI=1S/C4H8N2O3/c5-4(9)6-2-1-3(7)8/h1-2H2,(H,7,8)(H3,5,6,9) |
| InChIKey | InChI | 1.03 | JSJWCHRYRHKBBW-UHFFFAOYSA-N |
