PDB CCD ID: | S7Z |
Number of entries in BioLiP: | 0 |
Chemical formula: | C14 H6 F4 N2 O4 |
InChI: | InChI=1S/C14H6F4N2O4/c15-7-1-5(13(21)22)2-8(16)11(7)19-20-12-9(17)3-6(14(23)24)4-10(12)18/h1-4H,(H,21,22)(H,23,24)/b20-19- |
InChIKey: | UGNSRBICRLILLW-VXPUYCOJSA-N |
SMILES: | Software | SMILES |
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OpenEye OEToolkits 2.0.7 | c1c(cc(c(c1F)N=Nc2c(cc(cc2F)C(=O)O)F)F)C(=O)O | OpenEye OEToolkits 2.0.7 | c1c(cc(c(c1F)/N=N\c2c(cc(cc2F)C(=O)O)F)F)C(=O)O | CACTVS 3.385 | OC(=O)c1cc(F)c(N=Nc2c(F)cc(cc2F)C(O)=O)c(F)c1 |
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Name: | (E)-(4-((2,6-difluoro-4-(hydroxymethyl)phenyl)diazenyl)-2,6-difluorophenyl)methanol; [4-[(~{Z})-[2,6-bis(fluoranyl)-4-(hydroxymethyl)phenyl]diazenyl]-3,5-bis(fluoranyl)phenyl]methanol |