| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | N#Cc4ccc(OCCCN1CCC(CC1)C(c2ccccc2)(N)C3CCCC3)cc4 |
| InChI | InChI | 1.03 | InChI=1S/C27H35N3O/c28-21-22-11-13-26(14-12-22)31-20-6-17-30-18-15-25(16-19-30)27(29,24-9-4-5-10-24)23-7-2-1-3-8-23/h1-3,7-8,11-14,24-25H,4-6,9-10,15-20,29H2/t27-/m1/s1 |
| InChIKey | InChI | 1.03 | AUWUGRCKTQSGJY-HHHXNRCGSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | N[C@](C1CCCC1)(C2CCN(CCCOc3ccc(cc3)C#N)CC2)c4ccccc4 |
| SMILES | CACTVS | 3.385 | N[C](C1CCCC1)(C2CCN(CCCOc3ccc(cc3)C#N)CC2)c4ccccc4 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.6 | c1ccc(cc1)[C@@](C2CCCC2)(C3CCN(CC3)CCCOc4ccc(cc4)C#N)N |
| SMILES | OpenEye OEToolkits | 1.7.6 | c1ccc(cc1)C(C2CCCC2)(C3CCN(CC3)CCCOc4ccc(cc4)C#N)N |
