Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | CC(O)(CCCc1ccccc1)c1cc(ccc1O)C(=O)N1Cc2ccc(F)cc2C1 |
InChI | InChI | 1.03 | InChI=1S/C26H26FNO3/c1-26(31,13-5-8-18-6-3-2-4-7-18)23-15-19(10-12-24(23)29)25(30)28-16-20-9-11-22(27)14-21(20)17-28/h2-4,6-7,9-12,14-15,29,31H,5,8,13,16-17H2,1H3/t26-/m0/s1 |
InChIKey | InChI | 1.03 | CRJBRLBNXARYEQ-SANMLTNESA-N |
SMILES_CANONICAL | CACTVS | 3.385 | C[C@](O)(CCCc1ccccc1)c2cc(ccc2O)C(=O)N3Cc4ccc(F)cc4C3 |
SMILES | CACTVS | 3.385 | C[C](O)(CCCc1ccccc1)c2cc(ccc2O)C(=O)N3Cc4ccc(F)cc4C3 |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | C[C@](CCCc1ccccc1)(c2cc(ccc2O)C(=O)N3Cc4ccc(cc4C3)F)O |
SMILES | OpenEye OEToolkits | 2.0.7 | CC(CCCc1ccccc1)(c2cc(ccc2O)C(=O)N3Cc4ccc(cc4C3)F)O |