Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | O=C(N(C)CC(=O)Nc1ccc(OC)cc1)C1(CCCC1)c1ccccc1 |
InChI | InChI | 1.03 | InChI=1S/C22H26N2O3/c1-24(16-20(25)23-18-10-12-19(27-2)13-11-18)21(26)22(14-6-7-15-22)17-8-4-3-5-9-17/h3-5,8-13H,6-7,14-16H2,1-2H3,(H,23,25) |
InChIKey | InChI | 1.03 | DKCHMKRLQSFONS-UHFFFAOYSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | COc1ccc(NC(=O)CN(C)C(=O)C2(CCCC2)c3ccccc3)cc1 |
SMILES | CACTVS | 3.385 | COc1ccc(NC(=O)CN(C)C(=O)C2(CCCC2)c3ccccc3)cc1 |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | CN(CC(=O)Nc1ccc(cc1)OC)C(=O)C2(CCCC2)c3ccccc3 |
SMILES | OpenEye OEToolkits | 2.0.7 | CN(CC(=O)Nc1ccc(cc1)OC)C(=O)C2(CCCC2)c3ccccc3 |