Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | c1(c(ccc(c1)C(C(O)=O)C)c2cc(ccc2)OC(=O)NCCCCCC)F |
InChI | InChI | 1.03 | InChI=1S/C22H26FNO4/c1-3-4-5-6-12-24-22(27)28-18-9-7-8-17(13-18)19-11-10-16(14-20(19)23)15(2)21(25)26/h7-11,13-15H,3-6,12H2,1-2H3,(H,24,27)(H,25,26)/t15-/m0/s1 |
InChIKey | InChI | 1.03 | USQOVYLRWBOSQC-HNNXBMFYSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | CCCCCCNC(=O)Oc1cccc(c1)c2ccc(cc2F)[C@H](C)C(O)=O |
SMILES | CACTVS | 3.385 | CCCCCCNC(=O)Oc1cccc(c1)c2ccc(cc2F)[CH](C)C(O)=O |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | CCCCCCNC(=O)Oc1cccc(c1)c2ccc(cc2F)[C@H](C)C(=O)O |
SMILES | OpenEye OEToolkits | 2.0.6 | CCCCCCNC(=O)Oc1cccc(c1)c2ccc(cc2F)C(C)C(=O)O |