Type | Program | Version | Descriptor |
InChI | InChI | 1.06 | InChI=1S/C18H22Cl2N2O3/c19-11-16(23)21-12-13-5-9-22(10-6-13)17(24)18(7-8-18)25-15-3-1-14(20)2-4-15/h1-4,13H,5-12H2,(H,21,23) |
InChIKey | InChI | 1.06 | QXDWNDTZFISQJX-UHFFFAOYSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | ClCC(=O)NCC1CCN(CC1)C(=O)C2(CC2)Oc3ccc(Cl)cc3 |
SMILES | CACTVS | 3.385 | ClCC(=O)NCC1CCN(CC1)C(=O)C2(CC2)Oc3ccc(Cl)cc3 |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | c1cc(ccc1OC2(CC2)C(=O)N3CCC(CC3)CNC(=O)CCl)Cl |
SMILES | OpenEye OEToolkits | 2.0.7 | c1cc(ccc1OC2(CC2)C(=O)N3CCC(CC3)CNC(=O)CCl)Cl |