| 種別 | プログラム | バージョン | 表記 |
| SMILES | ACDLabs | 12.01 | c1(nc(ccc1)CCc2cccc(c2)OCc3cc4c(cc3)ccc(N)n4)N |
| InChI | InChI | 1.03 | InChI=1S/C23H22N4O/c24-22-6-2-4-19(26-22)11-8-16-3-1-5-20(13-16)28-15-17-7-9-18-10-12-23(25)27-21(18)14-17/h1-7,9-10,12-14H,8,11,15H2,(H2,24,26)(H2,25,27) |
| InChIKey | InChI | 1.03 | WNELLCJMJQCVPO-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | Nc1cccc(CCc2cccc(OCc3ccc4ccc(N)nc4c3)c2)n1 |
| SMILES | CACTVS | 3.385 | Nc1cccc(CCc2cccc(OCc3ccc4ccc(N)nc4c3)c2)n1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | c1cc(cc(c1)OCc2ccc3ccc(nc3c2)N)CCc4cccc(n4)N |
| SMILES | OpenEye OEToolkits | 2.0.7 | c1cc(cc(c1)OCc2ccc3ccc(nc3c2)N)CCc4cccc(n4)N |
