Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | O=C(NCC1CC1)N1CCN(CC1)C(=O)c1ccc(Cl)c(Cl)c1 |
InChI | InChI | 1.06 | InChI=1S/C16H19Cl2N3O2/c17-13-4-3-12(9-14(13)18)15(22)20-5-7-21(8-6-20)16(23)19-10-11-1-2-11/h3-4,9,11H,1-2,5-8,10H2,(H,19,23) |
InChIKey | InChI | 1.06 | DPRJGBYDJHMEPY-UHFFFAOYSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | Clc1ccc(cc1Cl)C(=O)N2CCN(CC2)C(=O)NCC3CC3 |
SMILES | CACTVS | 3.385 | Clc1ccc(cc1Cl)C(=O)N2CCN(CC2)C(=O)NCC3CC3 |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | c1cc(c(cc1C(=O)N2CCN(CC2)C(=O)NCC3CC3)Cl)Cl |
SMILES | OpenEye OEToolkits | 2.0.7 | c1cc(c(cc1C(=O)N2CCN(CC2)C(=O)NCC3CC3)Cl)Cl |