Type | Program | Version | Descriptor |
InChI | InChI | 1.06 | InChI=1S/C23H22N2O2/c1-16(26)25-15-19(17-8-3-2-4-9-17)14-22(25)23(27)24-21-13-7-11-18-10-5-6-12-20(18)21/h2-13,19,22H,14-15H2,1H3,(H,24,27)/t19-,22+/m0/s1 |
InChIKey | InChI | 1.06 | HXZFWDRYUUGFOU-SIKLNZKXSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | CC(=O)N1C[C@H](C[C@@H]1C(=O)Nc2cccc3ccccc23)c4ccccc4 |
SMILES | CACTVS | 3.385 | CC(=O)N1C[CH](C[CH]1C(=O)Nc2cccc3ccccc23)c4ccccc4 |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | CC(=O)N1C[C@H](C[C@@H]1C(=O)Nc2cccc3c2cccc3)c4ccccc4 |
SMILES | OpenEye OEToolkits | 2.0.7 | CC(=O)N1CC(CC1C(=O)Nc2cccc3c2cccc3)c4ccccc4 |