Type | Program | Version | Descriptor |
SMILES | ACDLabs | 10.04 | O=C(O)c3ccccc3/N=N/c2c1ccccc1c(O)cc2 |
SMILES_CANONICAL | CACTVS | 3.341 | OC(=O)c1ccccc1N=Nc2ccc(O)c3ccccc23 |
SMILES | CACTVS | 3.341 | OC(=O)c1ccccc1N=Nc2ccc(O)c3ccccc23 |
SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | c1ccc2c(c1)c(ccc2O)/N=N/c3ccccc3C(=O)O |
SMILES | OpenEye OEToolkits | 1.5.0 | c1ccc2c(c1)c(ccc2O)N=Nc3ccccc3C(=O)O |
InChI | InChI | 1.03 | InChI=1S/C17H12N2O3/c20-16-10-9-15(11-5-1-2-6-12(11)16)19-18-14-8-4-3-7-13(14)17(21)22/h1-10,20H,(H,21,22)/b19-18+ |
InChIKey | InChI | 1.03 | SXAUIPSOPPASFY-VHEBQXMUSA-N |