Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | c21nc(N)cc(c1ccc(c2)c3ccc(OCCC)c(c3)CN)C |
InChI | InChI | 1.03 | InChI=1S/C20H23N3O/c1-3-8-24-19-7-5-14(10-16(19)12-21)15-4-6-17-13(2)9-20(22)23-18(17)11-15/h4-7,9-11H,3,8,12,21H2,1-2H3,(H2,22,23) |
InChIKey | InChI | 1.03 | WKYWHPWEQYJUAT-UHFFFAOYSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | CCCOc1ccc(cc1CN)c2ccc3c(C)cc(N)nc3c2 |
SMILES | CACTVS | 3.385 | CCCOc1ccc(cc1CN)c2ccc3c(C)cc(N)nc3c2 |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | CCCOc1ccc(cc1CN)c2ccc3c(cc(nc3c2)N)C |
SMILES | OpenEye OEToolkits | 2.0.7 | CCCOc1ccc(cc1CN)c2ccc3c(cc(nc3c2)N)C |