| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | c1cc4c(cc1)c(CCCOc3c2ccccc2ccc3)c(C(=O)O)n4 |
| InChI | InChI | 1.03 | InChI=1S/C22H19NO3/c24-22(25)21-18(17-10-3-4-12-19(17)23-21)11-6-14-26-20-13-5-8-15-7-1-2-9-16(15)20/h1-5,7-10,12-13,23H,6,11,14H2,(H,24,25) |
| InChIKey | InChI | 1.03 | IQTBMDSOBZUIII-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | OC(=O)c1[nH]c2ccccc2c1CCCOc3cccc4ccccc34 |
| SMILES | CACTVS | 3.385 | OC(=O)c1[nH]c2ccccc2c1CCCOc3cccc4ccccc34 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | c1ccc2c(c1)cccc2OCCCc3c4ccccc4[nH]c3C(=O)O |
| SMILES | OpenEye OEToolkits | 2.0.6 | c1ccc2c(c1)cccc2OCCCc3c4ccccc4[nH]c3C(=O)O |
