| PDB CCD ID: | L85 |
| Number of entries in BioLiP: | 1 |
| Chemical formula: | C12 H10 N2 O4 S |
| InChI: | InChI=1S/C12H10N2O4S/c15-11-5-1-9(2-6-11)13-14-10-3-7-12(8-4-10)19(16,17)18/h1-8,15H,(H,16,17,18)/b14-13+ |
| InChIKey: | CNYMBHPFLJWLJW-BUHFOSPRSA-N |
| SMILES: | | Software | SMILES |
|---|
| OpenEye OEToolkits 1.7.0 | c1cc(ccc1N=Nc2ccc(cc2)S(=O)(=O)O)O | | OpenEye OEToolkits 1.7.0 | c1cc(ccc1/N=N/c2ccc(cc2)S(=O)(=O)O)O | | ACDLabs 12.01 | O=S(=O)(O)c2ccc(/N=N/c1ccc(O)cc1)cc2 | | CACTVS 3.370 | Oc1ccc(cc1)N=Nc2ccc(cc2)[S](O)(=O)=O |
|
| Name: | 4-[(E)-(4-hydroxyphenyl)diazenyl]benzenesulfonic acid |
| ZINC: | ZINC000004404103 |
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