A1D71
Summary
| Name: | 3-chloranyl-5-oxidanyl-benzoic acid |
| Synonyms: | Hydantoin-5-acetic acid |
| Formula: | C7 H5 Cl O3 |
| Formal charge: | 0 |
| Formula weight: | 172.566 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | 3-chloranyl-5-oxidanyl-benzoic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.06 | InChI=1S/C7H5ClO3/c8-5-1-4(7(10)11)2-6(9)3-5/h1-3,9H,(H,10,11) |
| InChIKey | InChI | 1.06 | RJOLIYHZZKAIET-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | Oc1cc(Cl)cc(c1)C(O)=O |
| SMILES | CACTVS | 3.385 | Oc1cc(Cl)cc(c1)C(O)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | c1c(cc(cc1O)Cl)C(=O)O |
| SMILES | OpenEye OEToolkits | 2.0.7 | c1c(cc(cc1O)Cl)C(=O)O |
