| Type | Program | Version | Descriptor |
| InChI | InChI | 1.06 | InChI=1S/C40H56ClN3O3/c1-39(2)32-18-10-12-20-34(32)43(5)36(39)22-17-23-37-40(3,4)33-19-11-13-21-35(33)44(37)27-15-8-9-24-38(45)42-26-29-47-31-30-46-28-16-7-6-14-25-41/h10-13,17-23H,6-9,14-16,24-31H2,1-5H3/p+1 |
| InChIKey | InChI | 1.06 | PMDIAZIQXAWRGJ-UHFFFAOYSA-O |
| SMILES_CANONICAL | CACTVS | 3.385 | CN\1c2ccccc2C(C)(C)C\1=C\C=C\C3=[N+](CCCCCC(=O)NCCOCCOCCCCCCCl)c4ccccc4C3(C)C |
| SMILES | CACTVS | 3.385 | CN1c2ccccc2C(C)(C)C1=CC=CC3=[N+](CCCCCC(=O)NCCOCCOCCCCCCCl)c4ccccc4C3(C)C |
| SMILES_CANONICAL | OpenEye OEToolkits | 3.1.0.0 | CC1(c2ccccc2[N+](=C1/C=C/C=C3C(c4ccccc4N3C)(C)C)CCCCCC(=O)NCCOCCOCCCCCCCl)C |
| SMILES | OpenEye OEToolkits | 3.1.0.0 | CC1(c2ccccc2[N+](=C1C=CC=C3C(c4ccccc4N3C)(C)C)CCCCCC(=O)NCCOCCOCCCCCCCl)C |
