| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 11.02 | n2c1cc(OC)c(OC)cc1c5c(c2)c(nc(c4cc(OCC(N)Cc3ccccc3)cnc4)c5)N |
| SMILES_CANONICAL | CACTVS | 3.352 | COc1cc2ncc3c(N)nc(cc3c2cc1OC)c4cncc(OC[C@@H](N)Cc5ccccc5)c4 |
| SMILES | CACTVS | 3.352 | COc1cc2ncc3c(N)nc(cc3c2cc1OC)c4cncc(OC[CH](N)Cc5ccccc5)c4 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.0 | COc1cc2c3cc(nc(c3cnc2cc1OC)N)c4cc(cnc4)OC[C@H](Cc5ccccc5)N |
| SMILES | OpenEye OEToolkits | 1.7.0 | COc1cc2c3cc(nc(c3cnc2cc1OC)N)c4cc(cnc4)OCC(Cc5ccccc5)N |
| InChI | InChI | 1.03 | InChI=1S/C28H27N5O3/c1-34-26-11-22-21-10-24(33-28(30)23(21)15-32-25(22)12-27(26)35-2)18-9-20(14-31-13-18)36-16-19(29)8-17-6-4-3-5-7-17/h3-7,9-15,19H,8,16,29H2,1-2H3,(H2,30,33)/t19-/m0/s1 |
| InChIKey | InChI | 1.03 | XNXUJUXYVTYIGP-IBGZPJMESA-N |
