Type | Program | Version | Descriptor |
SMILES | ACDLabs | 10.04 | O=C3C(=N\O)/c2c(c1ccccc1)cccc2N3Cc5cc(F)cc4c5OCOC4 |
SMILES_CANONICAL | CACTVS | 3.341 | O\N=C1/C(=O)N(Cc2cc(F)cc3COCOc23)c4cccc(c5ccccc5)c14 |
SMILES | CACTVS | 3.341 | ON=C1C(=O)N(Cc2cc(F)cc3COCOc23)c4cccc(c5ccccc5)c14 |
SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | c1ccc(cc1)c2cccc3c2/C(=N/O)/C(=O)N3Cc4cc(cc5c4OCOC5)F |
SMILES | OpenEye OEToolkits | 1.5.0 | c1ccc(cc1)c2cccc3c2C(=NO)C(=O)N3Cc4cc(cc5c4OCOC5)F |
InChI | InChI | 1.03 | InChI=1S/C23H17FN2O4/c24-17-9-15(22-16(10-17)12-29-13-30-22)11-26-19-8-4-7-18(14-5-2-1-3-6-14)20(19)21(25-28)23(26)27/h1-10,28H,11-13H2/b25-21- |
InChIKey | InChI | 1.03 | SZYREAUDQRVVLV-DAFNUICNSA-N |