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77L

Summary
Name:5-(4-fluorophenyl)-2,3-dihydroxy-N-(2-hydroxyethyl)benzamide
Formula:C15 H14 F N O4
Formal charge:0
Formula weight:291.274 Da
Component type:NON-POLYMER

Chemical Identifiers

ProgramVersionName
ACDLabs12.014'-fluoro-4,5-dihydroxy-N-(2-hydroxyethyl)[1,1'-biphenyl]-3-carboxamide
OpenEye OEToolkits1.7.65-(4-fluorophenyl)-N-(2-hydroxyethyl)-2,3-bis(oxidanyl)benzamide

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs12.01c2c(c1ccc(F)cc1)cc(c(c2C(=O)NCCO)O)O
InChIInChI1.03InChI=1S/C15H14FNO4/c16-11-3-1-9(2-4-11)10-7-12(14(20)13(19)8-10)15(21)17-5-6-18/h1-4,7-8,18-20H,5-6H2,(H,17,21)
InChIKeyInChI1.03ASGZSLFHJDBZNV-UHFFFAOYSA-N
SMILES_CANONICALCACTVS3.385OCCNC(=O)c1cc(cc(O)c1O)c2ccc(F)cc2
SMILESCACTVS3.385OCCNC(=O)c1cc(cc(O)c1O)c2ccc(F)cc2
SMILES_CANONICALOpenEye OEToolkits1.7.6c1cc(ccc1c2cc(c(c(c2)O)O)C(=O)NCCO)F
SMILESOpenEye OEToolkits1.7.6c1cc(ccc1c2cc(c(c(c2)O)O)C(=O)NCCO)F

223166

PDB entries from 2024-07-31

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