Type | Program | Version | Descriptor |
InChI | InChI | 1.06 | InChI=1S/C19H26ClN3O2/c20-13-17(24)21-14-15-7-11-23(12-8-15)18(25)19(9-4-10-19)22-16-5-2-1-3-6-16/h1-3,5-6,15,22H,4,7-14H2,(H,21,24) |
InChIKey | InChI | 1.06 | FTHNPKJZIJMFGT-UHFFFAOYSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | ClCC(=O)NCC1CCN(CC1)C(=O)C2(CCC2)Nc3ccccc3 |
SMILES | CACTVS | 3.385 | ClCC(=O)NCC1CCN(CC1)C(=O)C2(CCC2)Nc3ccccc3 |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | c1ccc(cc1)NC2(CCC2)C(=O)N3CCC(CC3)CNC(=O)CCl |
SMILES | OpenEye OEToolkits | 2.0.7 | c1ccc(cc1)NC2(CCC2)C(=O)N3CCC(CC3)CNC(=O)CCl |