C54
Summary
| Name: | (1R)-cyclopent-2-ene-1-carboxylic acid |
| Formula: | C6 H8 O2 |
| Formal charge: | 0 |
| Formula weight: | 112.127 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | (1R)-cyclopent-2-ene-1-carboxylic acid |
| OpenEye OEToolkits | 1.9.2 | (1R)-cyclopent-2-ene-1-carboxylic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | O=C(O)C1C=CCC1 |
| InChI | InChI | 1.03 | InChI=1S/C6H8O2/c7-6(8)5-3-1-2-4-5/h1,3,5H,2,4H2,(H,7,8)/t5-/m0/s1 |
| InChIKey | InChI | 1.03 | MOMBAXHNIPLMSI-YFKPBYRVSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | OC(=O)[C@@H]1CCC=C1 |
| SMILES | CACTVS | 3.385 | OC(=O)[CH]1CCC=C1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.9.2 | C1C[C@H](C=C1)C(=O)O |
| SMILES | OpenEye OEToolkits | 1.9.2 | C1CC(C=C1)C(=O)O |
