LXQ
Summary
| Name: | (3~{R})-1-ethanoylpyrrolidine-3-carboxylic acid |
| Formula: | C7 H11 N O3 |
| Formal charge: | 0 |
| Formula weight: | 157.167 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | (3~{R})-1-ethanoylpyrrolidine-3-carboxylic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C7H11NO3/c1-5(9)8-3-2-6(4-8)7(10)11/h6H,2-4H2,1H3,(H,10,11)/t6-/m1/s1 |
| InChIKey | InChI | 1.03 | FEQQMBBBBFVNMN-ZCFIWIBFSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CC(=O)N1CC[C@H](C1)C(O)=O |
| SMILES | CACTVS | 3.385 | CC(=O)N1CC[CH](C1)C(O)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | CC(=O)N1CC[C@H](C1)C(=O)O |
| SMILES | OpenEye OEToolkits | 2.0.7 | CC(=O)N1CCC(C1)C(=O)O |
