Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | c3cc(C(C(=O)Nc1ccc(cc1)[Si](C)(C)C)N(C)C(C2=CC(=O)NO2)=O)ccc3OC |
InChI | InChI | 1.03 | InChI=1S/C23H27N3O5Si/c1-26(23(29)19-14-20(27)25-31-19)21(15-6-10-17(30-2)11-7-15)22(28)24-16-8-12-18(13-9-16)32(3,4)5/h6-14,21H,1-5H3,(H,24,28)(H,25,27)/t21-/m1/s1 |
InChIKey | InChI | 1.03 | RQLIWGALGGOPGM-OAQYLSRUSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | COc1ccc(cc1)[C@@H](N(C)C(=O)C2=CC(=O)NO2)C(=O)Nc3ccc(cc3)[Si](C)(C)C |
SMILES | CACTVS | 3.385 | COc1ccc(cc1)[CH](N(C)C(=O)C2=CC(=O)NO2)C(=O)Nc3ccc(cc3)[Si](C)(C)C |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | CN([C@H](c1ccc(cc1)OC)C(=O)Nc2ccc(cc2)[Si](C)(C)C)C(=O)C3=CC(=O)NO3 |
SMILES | OpenEye OEToolkits | 2.0.6 | CN(C(c1ccc(cc1)OC)C(=O)Nc2ccc(cc2)[Si](C)(C)C)C(=O)C3=CC(=O)NO3 |