N80
Summary
| Name: | 1-ethenyl-L-proline |
| Formula: | C7 H11 N O2 |
| Formal charge: | 0 |
| Formula weight: | 141.168 Da |
| Component type: | L-peptide linking |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | 1-ethenyl-L-proline |
| OpenEye OEToolkits | 1.9.2 | (2S)-1-ethenylpyrrolidine-2-carboxylic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | O=C(O)C1N(\C=C)CCC1 |
| InChI | InChI | 1.03 | InChI=1S/C7H11NO2/c1-2-8-5-3-4-6(8)7(9)10/h2,6H,1,3-5H2,(H,9,10)/t6-/m0/s1 |
| InChIKey | InChI | 1.03 | XOTIFFOSEYHBBR-LURJTMIESA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | OC(=O)[C@@H]1CCCN1C=C |
| SMILES | CACTVS | 3.385 | OC(=O)[CH]1CCCN1C=C |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.9.2 | C=CN1CCC[C@H]1C(=O)O |
| SMILES | OpenEye OEToolkits | 1.9.2 | C=CN1CCCC1C(=O)O |
