DIU
Summary
| Name: | 2-HYDROXY-3,5-DIIODO-BENZOIC ACID |
| Synonyms: | 2-HYDROXY-3,5-DIIODOBENZOIC ACID |
| Formula: | C7 H4 I2 O3 |
| Formal charge: | 0 |
| Formula weight: | 389.914 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 10.04 | 2-hydroxy-3,5-diiodobenzoic acid |
| OpenEye OEToolkits | 1.5.0 | 2-hydroxy-3,5-diiodo-benzoic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | Ic1cc(C(=O)O)c(O)c(I)c1 |
| SMILES_CANONICAL | CACTVS | 3.341 | OC(=O)c1cc(I)cc(I)c1O |
| SMILES | CACTVS | 3.341 | OC(=O)c1cc(I)cc(I)c1O |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | c1c(cc(c(c1C(=O)O)O)I)I |
| SMILES | OpenEye OEToolkits | 1.5.0 | c1c(cc(c(c1C(=O)O)O)I)I |
| InChI | InChI | 1.03 | InChI=1S/C7H4I2O3/c8-3-1-4(7(11)12)6(10)5(9)2-3/h1-2,10H,(H,11,12) |
| InChIKey | InChI | 1.03 | DHZVWQPHNWDCFS-UHFFFAOYSA-N |
