Type | Program | Version | Descriptor |
InChI | InChI | 1.03 | InChI=1S/C29H42N2O4/c1-5-8-9-10-11-14-22-34-27-16-13-12-15-26(27)28(32)30-25-19-17-24(18-20-25)29(33)35-23-21-31(4,6-2)7-3/h12-13,15-20H,5-11,14,21-23H2,1-4H3/p+1 |
InChIKey | InChI | 1.03 | NQHNLNLJPDMBFN-UHFFFAOYSA-O |
SMILES_CANONICAL | CACTVS | 3.385 | CCCCCCCCOc1ccccc1C(=O)Nc2ccc(cc2)C(=O)OCC[N+](C)(CC)CC |
SMILES | CACTVS | 3.385 | CCCCCCCCOc1ccccc1C(=O)Nc2ccc(cc2)C(=O)OCC[N+](C)(CC)CC |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | CCCCCCCCOc1ccccc1C(=O)Nc2ccc(cc2)C(=O)OCC[N+](C)(CC)CC |
SMILES | OpenEye OEToolkits | 2.0.7 | CCCCCCCCOc1ccccc1C(=O)Nc2ccc(cc2)C(=O)OCC[N+](C)(CC)CC |