Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | O=C(C1=CC(=O)NC(=O)N1)N1CCN(CC1)c1ccc(Cl)cc1 |
InChI | InChI | 1.03 | InChI=1S/C15H15ClN4O3/c16-10-1-3-11(4-2-10)19-5-7-20(8-6-19)14(22)12-9-13(21)18-15(23)17-12/h1-4,9H,5-8H2,(H2,17,18,21,23) |
InChIKey | InChI | 1.03 | UPTYXISDRSIHCH-UHFFFAOYSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | Clc1ccc(cc1)N2CCN(CC2)C(=O)C3=CC(=O)NC(=O)N3 |
SMILES | CACTVS | 3.385 | Clc1ccc(cc1)N2CCN(CC2)C(=O)C3=CC(=O)NC(=O)N3 |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | c1cc(ccc1N2CCN(CC2)C(=O)C3=CC(=O)NC(=O)N3)Cl |
SMILES | OpenEye OEToolkits | 2.0.7 | c1cc(ccc1N2CCN(CC2)C(=O)C3=CC(=O)NC(=O)N3)Cl |