3239185 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 9 9 8 8 8 7 6 6 6 6 6 6 6 6 1 1 1 1 1 1 1 1 2 3 3 4 5 5 6 6 7 7 7 8 8 9 9 10 10 11 12 14 14 14 8 14 13 6 21 13 20 9 10 13 11 12 11 15 12 16 17 18 19 1 1 1 1 2 1 1 1 1 2 1 1 2 1 1 1 2 1 1 1 1 1 5 255 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 2 2.866 3.732 2.866 4.5981 4.5981 3.732 3.732 2.866 4.5981 2.866 4.5981 3.732 2.866 2.3291 5.135 2.3291 5.135 2.866 5.135 5.135 -2.155 -3.655 -2.155 2.345 3.345 2.345 0.845 -1.155 0.345 0.345 -0.655 -0.655 1.845 -2.655 0.655 0.655 -0.965 -0.965 -2.035 2.035 3.655 8 8 8 8 8 8 7 7 8 8 9 10 9 10 11 12 11 12 0 Compound Canonicalized 5 2021.10.14 1 Compound Complexity 7 E_COMPLEXITY 3.4.8.18 Cactvs Xemistry GmbH 2021.10.14 193 Count Hydrogen Bond Acceptor 5 E_NHACCEPTORS 3.4.8.18 Cactvs Xemistry GmbH 2021.10.14 5 Count Hydrogen Bond Donor 5 E_NHDONORS 3.4.8.18 Cactvs Xemistry GmbH 2021.10.14 2 Count Rotatable Bond 5 E_NROTBONDS 3.4.8.18 Cactvs Xemistry GmbH 2021.10.14 3 Fingerprint SubStructure Keys 16 extended 2 E_SCREEN 3.4.8.18 Cactvs Xemistry GmbH 2021.10.14 0000037180723180000000000000000000000000000000000000300000000000000000010000001F00140800000C04819812300680500400880221521000820800242000288801060CC80C263284B51B80312064C01108A98798DC00CE20000000000000004000000000000000000000000000 IUPAC Name Allowed 1 2.7.0 Lexichem TK OpenEye Scientific Software 2021.10.14 4-(difluoromethoxy)benzenecarbohydroxamic acid IUPAC Name CAS-like Style 1 2.7.0 Lexichem TK OpenEye Scientific Software 2021.10.14 4-(difluoromethoxy)-N-hydroxybenzamide IUPAC Name Markup 1 2.7.0 Lexichem TK OpenEye Scientific Software 2021.10.14 4-(difluoromethoxy)-<I>N</I>-hydroxybenzamide IUPAC Name Preferred 1 2.7.0 Lexichem TK OpenEye Scientific Software 2021.10.14 4-(difluoromethoxy)-N-hydroxybenzamide IUPAC Name Systematic 1 2.7.0 Lexichem TK OpenEye Scientific Software 2021.10.14 4-[bis(fluoranyl)methoxy]-N-oxidanyl-benzamide IUPAC Name Traditional 1 2.7.0 Lexichem TK OpenEye Scientific Software 2021.10.14 4-(difluoromethoxy)benzenecarbohydroxamic acid InChI Standard 1 1.0.6 InChI iupac.org 2021.10.14 InChI=1S/C8H7F2NO3/c9-8(10)14-6-3-1-5(2-4-6)7(12)11-13/h1-4,8,13H,(H,11,12) InChIKey Standard 1 1.0.6 InChI iupac.org 2021.10.14 FWRXDRYCPUODPN-UHFFFAOYSA-N Log P XLogP3-AA 7 3.0 sioc-ccbg.ac.cn 2021.10.14 1.6 Mass Exact 1 2.2 PubChem ncbi.nlm.nih.gov 2021.10.14 203.03939941 Molecular Formula 1 2.2 PubChem ncbi.nlm.nih.gov 2021.10.14 C8H7F2NO3 Molecular Weight 1 2.2 PubChem ncbi.nlm.nih.gov 2021.10.14 203.14 SMILES Canonical 1 2.3.0 OEChem OpenEye Scientific Software 2021.10.14 C1=CC(=CC=C1C(=O)NO)OC(F)F SMILES Isomeric 1 2.3.0 OEChem OpenEye Scientific Software 2021.10.14 C1=CC(=CC=C1C(=O)NO)OC(F)F Topological Polar Surface Area 7 E_TPSA 3.4.8.18 Cactvs Xemistry GmbH 2021.10.14 58.6 Weight MonoIsotopic 1 2.2 PubChem ncbi.nlm.nih.gov 2021.10.14 203.03939941 14 0 0 0 0 0 0 0 1 -1