Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | Clc1ccc(cc1)NC(=O)C(=O)NC2CC(NC(C)(C)C2)(C)C |
InChI | InChI | 1.03 | InChI=1S/C17H24ClN3O2/c1-16(2)9-13(10-17(3,4)21-16)20-15(23)14(22)19-12-7-5-11(18)6-8-12/h5-8,13,21H,9-10H2,1-4H3,(H,19,22)(H,20,23) |
InChIKey | InChI | 1.03 | ZKXLQCIOURANAD-UHFFFAOYSA-N |
SMILES_CANONICAL | CACTVS | 3.370 | CC1(C)CC(CC(C)(C)N1)NC(=O)C(=O)Nc2ccc(Cl)cc2 |
SMILES | CACTVS | 3.370 | CC1(C)CC(CC(C)(C)N1)NC(=O)C(=O)Nc2ccc(Cl)cc2 |
SMILES_CANONICAL | OpenEye OEToolkits | 1.7.6 | CC1(CC(CC(N1)(C)C)NC(=O)C(=O)Nc2ccc(cc2)Cl)C |
SMILES | OpenEye OEToolkits | 1.7.6 | CC1(CC(CC(N1)(C)C)NC(=O)C(=O)Nc2ccc(cc2)Cl)C |