Type | Program | Version | Descriptor |
SMILES | ACDLabs | 10.04 | O=C5c4c2c1cc(O)ccc1nc2cc(c3ccccc3)c4C(=O)N5 |
SMILES_CANONICAL | CACTVS | 3.341 | Oc1ccc2[nH]c3cc(c4ccccc4)c5C(=O)NC(=O)c5c3c2c1 |
SMILES | CACTVS | 3.341 | Oc1ccc2[nH]c3cc(c4ccccc4)c5C(=O)NC(=O)c5c3c2c1 |
SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | c1ccc(cc1)c2cc3c(c4cc(ccc4[nH]3)O)c5c2C(=O)NC5=O |
SMILES | OpenEye OEToolkits | 1.5.0 | c1ccc(cc1)c2cc3c(c4cc(ccc4[nH]3)O)c5c2C(=O)NC5=O |
InChI | InChI | 1.03 | InChI=1S/C20H12N2O3/c23-11-6-7-14-13(8-11)16-15(21-14)9-12(10-4-2-1-3-5-10)17-18(16)20(25)22-19(17)24/h1-9,21,23H,(H,22,24,25) |
InChIKey | InChI | 1.03 | IAUZTOZLTFSMIE-UHFFFAOYSA-N |